3-(Dimethylamino)-1-propanol (HCID 76646)

Überblick

dimethylamine precursor

Namen und Bezeichner

Bevorzugter Name: 3-(Dimethylamino)-1-propanol
IUPAC: 3-(dimethylamino)propan-1-ol
Lokaler Name: 3-Dimethylaminopropan-1-ol
Englischer Name: 3-Dimethylamino-1-propanol
Summenformel: C5H13NO
Molmasse: 103.16

Namen und Synonyme

3179-63-31-Propanol, 3-(dimethylamino)-3-(Dimethylamino)-1-propanolN,N-DimethylpropanolamineDimethylaminopropanol3-(Dimethylamino)propanolDimethylpropanolamine3-(N,N-Dimethylamino)propanol1-Dimethylamino-3-propanolN,N-Dimethyl-3-hydroxypropylamine3-(N,N-Dimethylamino)-1-propanolgamma-(Dimethylamino)propanol

Weitere Namen anzeigen

3-DIMETHYLAMINOPROPAN-1-OLN,N-DimethylaminopropanolRizatriptan Impurity 163-DIMETHYLAMINO PROPANOL3-Dimehylamino-1-propanol3-(Dimethlyamino)propanol

N,N-Dimethyl-gamma-aminopropanolRZ359222MZNSC-62086DTXSID5062895RefChem:134313DTXCID4038423221-659-23-Dimethylamino-1-propanol

Datenbank-Bezeichner

CAS: 3179-63-3
PubChem CID: 76646
DTXSID: DTXSID5062895
ChEMBL: CHEMBL1209424
UNII: RZ359222MZ
EC Number: 221-659-2
Nikkaji: J80.660I

Eigenschaften

Berechnete Struktureigenschaften

XLogP: -0,1
Polarare Oberfläche (TPSA): 23,5 Å²
H-Brücken-Donoren: 1
H-Brücken-Akzeptoren: 2
Frei drehbare Bindungen: 3
Schwere Atome: 7
Formalladung: 0
Komplexität: 37,1

Experimentelle und physikochemische Eigenschaften

Dissociation Constants9.3

Physikochemische Eigenschaften

Schmelzpunkt: -35 °C · -35 °C
Siedepunkt: 163 · 163-164 °C(lit.)
Dichte: 0.872 g/mL · 0.872 g/mL at 25 °C(lit.)
Dampfdruck: 1.56 hPa · 1.56hPa at 20℃
Brechungsindex: 20 · n20/D 1.436(lit.)
Flammpunkt: 97 °F · 97 °F
storage temp.: Flammables area
Löslichkeit: Chloroform (Sparingly), DMSO (Sparingly), Ethyl Acetate (Slightly), Methanol (Slightly)
pka: 15.02 · 15.02±0.10(Predicted)
Aggregatzustand: Liquid
Farbe: Clear colorless to yellow
PH: 11.3 · 11.3 (10g/l, H2O, 20℃)
Explosionsgrenze: 0.9 · 0.9-11.2%(V)
Wasserlöslichkeit: miscible
BRN: 1732032 · 1732032
Stabilität: Stable. Flammable. Incompatible with strong oxidizing agents.
InChI: 1S/C5H13NO/c1-6(2)4-3-5-7/h7H,3-5H2,1-2H3
InChIKey: PYSGFFTXMUWEOT-UHFFFAOYSA-N
SMILES: CN(C)CCCO
LogP: -2.59 at · -2.59 at 25℃
Oberflächenspannung: 29.01 mN/m · 29.01mN/m at 298.15K
CAS Datenbank: 3179 · 3179-63-3(CAS DataBase Reference)
NIST chemische Informationen: 1 · 1-Propanol, 3-(dimethylamino)-(3179-63-3)
EPA chemische Informationen: 1 · 1-Propanol, 3-(dimethylamino)- (3179-63-3)

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 4 Einträge

Danger

H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]

P210, P233, P240, P241, P242, P243, P260, P264, P264+P265, P270, P280, P301+P317, P301+P330+P331, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P317, P321, P330, P363, P370+P378, P403+P235, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 186 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Gefahrenhinweise

Regulatory Information · 3 Einträge

Chemical: 1-Propanol, 3-(dimethylamino)-

Status: Active Update: 05-01-2018 https://echa.europa.eu/registration-dossier/-/registered-dossier/12109

3-(Dimethylamino)-1-propanol: Does not have an individual approval but may be used under an appropriate group standard

Hazard Classes and CategoriesFlam. Liq. 3 (100%)

Sicherheitsdaten

F: 34
wgk: 1
tsca: TSCA listed
ridadr: UN 1987 3/PG 3
hs_code: 29221980
RTECS-Nr.: UB3155000
risk_code: 10-41-34-22
hazard_code: Xi,C
safety_code: 26-39-45-36/37/39-16
hazard_class: 8
packing_group: II
Speicherklasse: 3 - Flammable liquids
Hazard Classifications: Acute Tox. 4 OralEye Dam. 1Flam. Liq. 3Skin Corr. 1B

Chemie und Industrie

Verwendung und Herstellung

General Manufacturing Information1-Propanol, 3-(dimethylamino)-: ACTIVE

Anwendungen

Verwenden3-Dimethylamino-1-propanol, is an important raw material and intermediate used in Organic Synthesis, Pharmaceuticals, Agrochemicals and Dyestuff.