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2-Chlorpropyldimethylammoniumchlorid

2-Chloropropyldimethylamine hydrochloride

HCID 94294
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GrundinformationenNamen und BezeichnerEigenschaftenSicherheit und RegulatorischesChemie und IndustrieZugehörige ReaktionenNotizen zur Verbindung
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Grundinformationen

CAS
4584-49-0
Standard-SMILES
CC(Cl)CN(C)C.Cl
InChIKey
OCWGRWAYARCRTQ-UHFFFAOYSA-N
Summenformel
C5H13Cl2N
Durchschnittliche Molmasse
158,07 g/mol
Monoisotopische Masse
157,0425048

Namen und Bezeichner

Bevorzugter Name
2-Chloropropyldimethylamine hydrochloride
IUPAC
2-chloro-N,N-dimethylpropan-1-amine;hydrochloride
Lokaler Name
2-Chlorpropyldimethylammoniumchlorid
Englischer Name
2-Dimethylaminoisopropyl chloride hydrochloride
Summenformel
C5H13Cl2N
Molmasse
158.07

Namen und Synonyme

4584-49-02-chloropropyldimethylamine hydrochlorideDTXSID3024780(2-Chloropropyl)dimethylamine hydrochlorideNSC 535322-Chloro-N,N-dimethyl-1-propanamine hydrochlorideAO9WB15SNZAI3-26684NSC 5367EINECS 224-971-71-Propanamine, 2-chloro-N,N-dimethyl-, hydrochlorideNSC-5367
Weitere Namen anzeigen
DMIC2-DMPC2-DIMETHYLAMINO ISOPROPYL CHLORIDE HCLN,N-Dimethyl-2-chloropropylamine hydrochloride2-CHLOROPROPYLDIMETHYLAMMONIUM CHLORIDE2-CHLORO-N,N-DIMETHYLPROPYLAMINE HYDROCHLORIDE1-(DIMETHYLAMINO)-2-CHLOROPROPANE HYDROCHLORIDEB-DIMETHYLAMINOISOPROPYL CHLORIDE HYDROCHLORIDE2-DMPC 99%DMIC 99%min
UNII-AO9WB15SNZNSC-53532DTXCID2047801-Propanamine, 2-chloro-N,N-dimethyl-, hydrochloride (1:1)1-dimethylamino-2-propyl chloride hydrochloride1-DIMETHYLAMINOPROPAN-2-YL CHLORIDE HYDROCHLORIDERefChem:865352Chloropropyldimethylammonium chloride

Eigenschaften

Berechnete StruktureigenschaftenWird ergänzt

Polarare Oberfläche (TPSA)
3,2 Ų
H-Brücken-Donoren
1
H-Brücken-Akzeptoren
1
Frei drehbare Bindungen
2
Schwere Atome
8
Formalladung
0
Komplexität
45

Experimentelle und physikochemische Eigenschaften

Solubilitygreater than or equal to 100 mg/mL at 70 °F (NTP, 1992)
Melting Point381 to 383 °F (NTP, 1992)
Physical Description · 2 Einträge

2-chloro-n,n-dimethyl-1-propanamine hydrochloride is an off-white chunky solid. (NTP, 1992)

Off-white hygroscopic solid; [CAMEO] White to light cream hygroscopic powder; [Acros Organics MSDS]

Physikochemische Eigenschaften

Schmelzpunkt
187 · 187-190 °C(lit.)
storage temp.
30 °C · Store below +30°C.
Löslichkeit
2000 g/l · 2000g/l
Aggregatzustand
Crystalline Powder
Farbe
White to light cream
PH
5 · 5-6 (500g/l, H2O, 20℃)
Wasserlöslichkeit
2000 g/L · 2000 g/L (20 º C)
BRN
3670215 · 3670215

Sicherheit und Regulatorisches

Sicherheitsangaben dienen nur zur Orientierung und ersetzen weder das Sicherheitsdatenblatt (SDB) des Lieferanten noch geltende Vorschriften oder eine fachliche Bewertung.

GHS-Klassifizierung

GHS Classification · 5 Einträge

Danger

H301 (17.8%): Toxic if swallowed [Danger Acute toxicity, oral];H302 (80.8%): Harmful if swallowed [Warning Acute toxicity, oral];H315 (93.2%): Causes skin irritation [Warning Skin corrosion/irritation];H319 (93.2%): Causes serious eye irritation [Warning Serious eye damage/eye irritation];H335 (76.7%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation];H400 (15.1%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard];H410 (15.1%): Very toxic to aquatic life with long lasting effects [Warning Hazardous to the aquatic environment, long-term hazard]

P261, P264, P264+P265, P270, P271, P273, P280, P301+P316, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P391, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 73 reports by companies from 13 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.;Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

Gefahrenhinweise

Regulatory Information · 2 Einträge

Status: Active Update: 09-02-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/21271

1-Propanamine, 2-chloro-N,N-dimethyl-, hydrochloride: Does not have an individual approval but may be used under an appropriate group standard

DOT LabelPoison
Fire HazardsFlash point data for this chemical are not available; however, it is probably combustible. (NTP, 1992)

Chemie und Industrie

Verwendung und Herstellung

General Manufacturing Information1-Propanamine, 2-chloro-N,N-dimethyl-, hydrochloride (1:1): ACTIVE

Anwendungen

Verwenden2-Chloro-N,N-dimethylpropylamine hydrochloride (DMIC) is used as intermediate for the syntheses of pharmaceuticals (e.g. isothipendyl, methadone and promethazine)

Vor- und nachgelagerte Produkte

Vorgelagerte Rohstoffe

1-Dimethylaminopropan-2-olThionyldichlorid

Anbieter100 Anbieter

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
Shandong chuangyingchemical Co., Ltd.18853181302 · [email protected]
Hong Kong Tiansheng New Material Trading Co., Ltd+8617320695765 · [email protected]
武汉欣扬瑞和化学科技有限公司153-07155313 15307155313 · [email protected]
河北展药生物科技有限公司15369953316 +8615369953316 · [email protected]
Baoji Guokang Healthchem co.,ltd+8615604608665 15604608665 · [email protected]

Zugehörige Reaktionen

6
Reaktionsaufzeichnung erstellen
Reaktionsgleichung von HRID 436134
HRID 436134als Eduktuspto-grants-1977_02
Reaktionsgleichung von HRID 726793
HRID 726793als Eduktuspto-grants-1998_01
Reaktionsgleichung von HRID 839292
HRID 839292als Eduktuspto-grants-1978_06
Reaktionsgleichung von HRID 1111364
HRID 1111364als Eduktuspto-grants-1990_12
Reaktionsgleichung von HRID 1494407
HRID 1494407als Eduktuspto-grants-1991_06
Reaktionsgleichung von HRID 1606442
HRID 1606442als Eduktuspto-grants-1976_04

Notizen zur Verbindung

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Datenbank-Bezeichner

CAS
4584-49-0
PubChem CID
94294
DTXSID
DTXSID3024780
UNII
AO9WB15SNZ
EC Number
224-971-7
InChI
InChI=1S/C5H12ClN.ClH/c1-5(6)4-7(2)3;/h5H,4H2,1-3H3;1H
InChIKey
OCWGRWAYARCRTQ-UHFFFAOYSA-N
SMILES
C(Cl)(C)CN(C)C.Cl
CAS Datenbank
4584 · 4584-49-0(CAS DataBase Reference)
EPA chemische Informationen
2 · 2-Chloro-N,N-dimethyl-1-propanamine hydrochloride (4584-49-0)
Health Hazards · 1 Eintrag

SYMPTOMS: Symptoms of exposure to this chemical may include irritation of the skin, eyes, mucous membranes and upper respiratory tract.;ACUTE/CHRONIC HAZARDS: This chemical may cause irritation. When heated to decomposition it emits toxic fumes of carbon monoxide, carbon dioxide, nitrogen oxides and hydrogen chloride gas. (NTP, 1992)

Hazards SummaryCauses somnolence in subcutaneous lethal-dose studies of mice (LD50 = 200 mg/kg); [RTECS] An irritant; [Acros Organics MSDS] See N,N-Dimethylaminoethyl chloride hydrochloride.
Reactive GroupAmines, Phosphines, and Pyridines;Halogenated Organic Compounds
Reactivity Profile · 1 Eintrag

2-CHLORO-N,N-DIMETHYL-1-PROPANAMINE HYDROCHLORIDE is incompatible with strong oxidizing agents. (NTP, 1992). Amines are chemical bases. They neutralize acids to form salts plus water. These acid-base reactions are exothermic. The amount of heat that is evolved per mole of amine in a neutralization is largely independent of the strength of the amine as a base. Amines may be incompatible with isocyanates, halogenated organics, peroxides, phenols (acidic), epoxides, anhydrides, and acid halides. Flammable gaseous hydrogen is generated by amines in combination with strong reducing agents, such as hydrides.

Air and Water ReactionsThis chemical is hygroscopic. Soluble in water.
Hazard Classes and CategoriesAcute Tox. 3 (17.8%);Acute Tox. 4 (80.8%);Skin Irrit. 2 (93.2%);Eye Irrit. 2 (93.2%);STOT SE 3 (76.7%);Aquatic Acute 1 (15.1%);Aquatic Chronic 1 (15.1%)

Sicherheit und Schutzausrüstung

Fire FightingFires involving this material can be controlled with a dry chemical, carbon dioxide or Halon extinguisher. (NTP, 1992)
First Aid · 1 Eintrag

EYES: First check the victim for contact lenses and remove if present. Flush victim's eyes with water or normal saline solution for 20 to 30 minutes while simultaneously calling a hospital or poison control center. Do not put any ointments, oils, or medication in the victim's eyes without specific instructions from a physician. IMMEDIATELY transport the victim after flushing eyes to a hospital even if no symptoms (such as redness or irritation) develop.;SKIN: IMMEDIATELY flood affected skin with water while removing and isolating all contaminated clothing. Gently wash all affected skin areas thoroughly with soap and water. If symptoms such as redness or irritation develop, IMMEDIATELY call a physician and be prepared to transport the victim to a hospital for treatment.;INHALATION: IMMEDIATELY leave the contaminated area; take deep breaths of fresh air. If symptoms (such as wheezing, coughing, shortness of breath, or burning in the mouth, throat, or chest) develop, call a physician and be prepared to transport the victim to a hospital. Provide proper respiratory protection to rescuers entering an unknown atmosphere. Whenever possible, Self-Contained Breathing Apparatus (SCBA) should be used; if not available, use a level of protection greater than or equal to that advised under Protective Clothing.;INGESTION: DO NOT INDUCE VOMITING. If the victim is conscious and not convulsing, give 1 or 2 glasses of water to dilute the chemical and IMMEDIATELY call a hospital or poison control center. Be prepared to transport the victim to a hospital if advised by a physician. If the victim is convulsing or unconscious, do not give anything by mouth, ensure that the victim's airway is open and lay the victim on his/her side with the head lower than the body. DO NOT INDUCE VOMITING. IMMEDIATELY transport the victim to a hospital. (NTP, 1992)

Nonfire Spill Response · 1 Eintrag

SMALL SPILLS AND LEAKAGE: If you spill this chemical, you should dampen the solid spill material with water, then transfer the dampened material to a suitable container. Use absorbent paper dampened with water to pick up any remaining material. Seal your contaminated clothing and the absorbent paper in a vapor-tight plastic bag for eventual disposal. Wash all contaminated surfaces with a soap and water solution. Do not reenter the contaminated area until the Safety Officer (or other responsible person) has verified that the area has been properly cleaned.;STORAGE PRECAUTIONS: You should store this chemical under ambient temperatures, and protect it from moisture. If possible, it would be prudent to store this compound under inert atmosphere. (NTP, 1992)

Isolation and Evacuation · 1 Eintrag

Excerpt from ERG Guide 154 [Substances - Toxic and/or Corrosive (Non-Combustible)]:;IMMEDIATE PRECAUTIONARY MEASURE: Isolate spill or leak area in all directions for at least 50 meters (150 feet) for liquids and at least 25 meters (75 feet) for solids.;SPILL: Increase the immediate precautionary measure distance, in the downwind direction, as necessary.;FIRE: If tank, rail tank car or highway tank is involved in a fire, ISOLATE for 800 meters (1/2 mile) in all directions; also, consider initial evacuation for 800 meters (1/2 mile) in all directions. (ERG, 2024)

Personal Protective Equipment (PPE) · 1 Eintrag

RECOMMENDED RESPIRATOR: Where the neat test chemical is weighed and diluted, wear a NIOSH-approved half face respirator equipped with an organic vapor/acid gas cartridge (specific for organic vapors, HCl, acid gas and SO2) with a dust/mist filter. (NTP, 1992)

Regulatorische Informationen

Regulatory Information · 2 Einträge

Status: Active Update: 09-02-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/21271

1-Propanamine, 2-chloro-N,N-dimethyl-, hydrochloride: Does not have an individual approval but may be used under an appropriate group standard

Sicherheitsdaten

wgk
3
tsca
TSCA listed
ridadr
2811
hs_code
29211980
RTECS-Nr.
TY1225000
risk_code
22-36/37/38
hazard_code
Xn,Xi
safety_code
26-36
hazard_class
6.1(b)
packing_group
III
Speicherklasse
6.1C - Combustible acute toxic Cat.3toxic compounds or compounds which causing chronic effects
Hazard Classifications
Acute Tox. 3 OralAquatic Acute 1Aquatic Chronic 1Eye Irrit. 2Skin Irrit. 2STOT SE 3
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
Hebei Yanxi Chemical Co., Ltd.+86-17531190177 · [email protected]
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宁波亿诺化学品有限公司86-574-27787657 · [email protected]
阿法埃莎(中国)化学有限公司400-6106006 · [email protected]
安耐吉化学&3A(安徽泽升科技股份有限公司)400-0056266 · [email protected]
浙江泽天精细化工有限公司18957127338 · [email protected]
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河北缤享新材料科技有限公司+8618633865755 · [email protected]
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Zhejiang J&C Biological Technology Co.,Limited+1-2135480471 · [email protected]
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玛雅试剂+86 (573) 82222445 (0)18006601000 452520369 · [email protected]
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天津希恩思生化科技有限公司400 638 7771 · [email protected]
Xiamen AmoyChem Co., Ltd+86-86-5926051114 · [email protected]
湖南汇百侍生物科技有限公司0731-85526065 13308475853 · [email protected]
南京维奥化工有限公司Please Send Email 18652950785 · [email protected]
Hebei Qige Biological Technology Co. Ltd+86 +8618733132031
Syntor Fine Chemicals Ltd.+44 (0) 1928 579865 · [email protected]
天津科创医药中间体技术生产力促进有限公司022-60116533 13207668525 · [email protected]
赛默飞世尔科技(中国)有限公司800-810-5118 · [email protected]
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TCI AMERICA800-4238616 · [email protected]
TOKYO CHEMICAL INDUSTRY CO., LTD.03-36680489 · [email protected]
TCI Europe320-37350700 · [email protected]
Shanghai Witofly Chemical Co.,Ltd[email protected]
成都零六生物科技有限公司400-1166-196 13458535857 · [email protected]
上海御略医药科技有限公司021-60345187 13671753212 · [email protected]
杭州杰恒化工有限公司0571-87396432 · [email protected]
上海寰川实业有限公司021-61478794 · [email protected]
上海兴鲁化工科技有限公司02120970332 · [email protected]
湖北巨胜科技有限公司027-59599241 18871490274 · [email protected]
池州凯隆进出口贸易有限公司[email protected]
Sigma-Aldrich西格玛奥德里奇(上海)贸易有限公司021-61415566 800-8193336 · [email protected]
Shanghai Tengben Biotechnology Co., Ltd+8615383194669 · [email protected]
TargetMol中国(陶术生物)021-021-33632979 15002134094 · [email protected]