Basic information
- Standard SMILES
CCCCC(CC)CNCC(CC)CCCC- InChIKey
SAIKULLUBZKPDA-UHFFFAOYSA-N- Molecular formula
- C16H35N
- Average molar mass
- 241.46 g/mol
- Monoisotopic mass
- 241.27695012
Overview
2,2'-diethylhexylamine is a clear colorless liquid with a slight ammonia-like odor. (NTP, 1992)
Names & identifiers
- Preferred name
- Bis(2-ethylhexyl)amine
- IUPAC
- 2-ethyl-N-(2-ethylhexyl)hexan-1-amine
- English name
- Bis(2-ethylhexyl)amine
- Molecular formula
- C16H35N
- Molecular weight
- 241.46
Names & synonyms
Bis(2-ethylhexyl)amine106-20-71-Hexanamine, 2-ethyl-N-(2-ethylhexyl)-RefChem:1079934Di(2-ethylhexyl)amineBis-2-ethylhexylamine2-ethyl-N-(2-ethylhexyl)hexan-1-amine2,2'-DiethyldihexylamineDiethylhexylamineDihexylamine, 2,2'-diethyl-2,2'-DIETHYLHEXYLAMINENSC 5329
Show more names
DIISOOCTYLAMINED2HDI2 EHAis2-ethylhexyl4-DifluorobenzoateTwo isooctyl amineTwo-ethylhexyl aMineBis(2-ethylhexyl)amiBis-2-ethylhexylamin
2-Ethyl-N-(2-ethylhexyl)-1-hexanamineDTXSID7025053MFCD0000948927214-52-49U5Q5UV6DBNSC-5329Di-(2-ethylhexyl)amine1-Hexylamine, 2-ethyl-N-(2-ethylhexyl)-
Database identifiers
- CAS
106-20-7、27214-52-4- PubChem CID
- 7791
- DTXSID
DTXSID7025053- ChEMBL
CHEMBL1330355- ChEBI
CHEBI:193588- UNII
- 9U5Q5UV6DB
- EC Number
- 203-372-4、248-331-1
- Nikkaji
- J27.961G
Properties
Computed structural properties
- XLogP
- 6.1
- Topological polar surface area
- 12 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 12
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 128
Experimental & physicochemical properties
Chemical ClassesNitrogen Compounds -> Amines, Aliphatic
Cosmetics
Personal care product
Antistatic; Hair conditioning
SpringerMaterials PropertiesOptical coefficient
Density0.8062 at 68 °F (NTP, 1992) - Less dense than water; will float
Solubilityless than 1 mg/mL at 70 °F (NTP, 1992)
Flash Point
270 °F (NTP, 1992)
270 °F
Boiling Point538 °F at 760 mmHg (NTP, 1992)
Vapor Density8.35 (NTP, 1992) - Heavier than air; will sink (Relative to Air)
Vapor Pressure
0.01 mmHg at 68 °F (NTP, 1992)
0.01 [mmHg]
Physical Description
2,2'-diethylhexylamine is a clear colorless liquid with a slight ammonia-like odor. (NTP, 1992)
Liquid
Clear colorless liquid with a slight ammonia-like odor; [CAMEO]
Physicochemical properties
- Melting point
- -60 °C · -60 °C
- Boiling point
- 123 °C5 · 123 °C5 mm Hg(lit.)
- Density
- 0.805 g/mL · 0.805 g/mL at 25 °C(lit.)
- vapor pressure
- 0.0023 hPa · 0.0023 hPa (20 °C)
- refractive index
- 20 · n20/D 1.443(lit.)
- Flash point
- 230 °F · >230 °F
- storage temp.
- 30 °C · Store below +30°C.
- solubility
- 0.014 g/l · 0.014g/l
- pka
- 40 · 40(at 25℃)
- form
- Liquid
- color
- Clear colorless to slightly yellow
- Specific Gravity
- 0.804 · 0.804 (20/4℃)
- PH
- 7 · >7 (H2O, 20℃)
- explosive limit
- 0.6 · 0.6-3.7%(V)
- Water Solubility
- 0.2 g/L · <0.2 g/L (20 ºC)
- BRN
- 1748342 · 1748342
- Stability
- Stable. Combustible. Incompatible with oxidizing agents.
- Cosmetics Ingredients Functions
- ANTISTATIC
- InChI
- 1S/C16H35N/c1-5-9-11-15(7-3)13-17-14-16(8-4)12-10-6-2/h15-17H,5-14H2,1-4H3
- InChIKey
- SAIKULLUBZKPDA-UHFFFAOYSA-N
- SMILES
- CCCCC(CC)CNCC(CC)CCCC
- LogP
- 7.3 at · 7.3 at 25℃
- CAS DataBase Reference
- 106 · 106-20-7(CAS DataBase Reference)
- EWG's Food Scores
- 1 · 1-4
- FDA UNII
- 9 U5Q5UV6DB · 9U5Q5UV6DB
- NIST Chemistry Reference
- 1 · 1-Hexanamine, 2-ethyl-N-(2-ethylhexyl)-(106-20-7)
- EPA Substance Registry System
- Di(2-ethylhexyl)amine (106-20-7)
- UNSPSC Code
- 12352116 · 12352116
- NACRES
- 22 · NA.22
- Symbol(GHS)
- 5 · GHS05,GHS06,GHS09
- Signal word
- Danger
- Hazard statements
- 302 · H302-H311+H331-H314-H410
- Precautionary statements
- 273 · P273-P280-P301+P312-P303+P361+P353-P304+P340+P310-P305+P351+P338
- PPE
- Faceshields, Gloves, Goggles, type ABEK (EN14387) respirator filter
- Hazard Codes
- C,Xi
- Risk Statements
- 21 · 21/22-34
- Safety Statements
- 26 · 26-36/37/39-45-36
- RIDADR
- 2735 · UN 2735 8/PG 2
- WGK Germany
- 2 · 2
- RTECS
- 6825000 · IH6825000
- Autoignition Temperature
- 230 °C · 230 °C
- Hazard Note
- Irritant/Corrosive
- TSCA
- TSCA listed
- HazardClass
- 8 · 8
- PackingGroup
- III
- HS Code
- 29211980 · 29211980
- Storage Class
- 6.1 A · 6.1A - Combustible acute toxic Cat. 1 and 2very toxic hazardous materials
- Hazard Classifications
- 3 DermalAcute · Acute Tox. 3 DermalAcute Tox. 3 InhalationAcute Tox. 4 OralAquatic Chronic 1Eye Dam. 1Skin Corr. 1B
- Toxicity
- 50 orally · LD50 orally in Rabbit: 1008 mg/kg LD50 dermal Rabbit 956 mg/kg
- REACH Registrations
- Active
- Limited Quantities
- 1 L · 1.0 L (0.3 gallons) (liquid) or 1 Kg (2.2 lbs) (solid)
- Excepted Quantities
- Max Inner Pack (30g or 30ml) and Max Outer Pack (500g or 500ml)
Safety & regulation
GHS classification
GHS Classification
This chemical does not meet GHS hazard criteria for 0.1% (1 of 669) of reports.
Danger
H302+H312 (65.9%): Harmful if swallowed or in contact with skin [Warning Acute toxicity, oral; acute toxicity, dermal]
P260, P261, P262, P264, P264+P265, P270, P271, P273, P280, P284, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P320, P321, P330, P361+P364, P362+P364, P363, P391, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 669 reports by companies from 17 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Not Classified
Hazard information
Regulatory Information
Chemical: 1-Hexanamine, 2-ethyl-N-(2-ethylhexyl)-
1-Hexanamine, 2-ethyl-N-(2-ethylhexyl)- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 1-Hexanamine, 2-ethyl-N-(2-ethylhexyl)- are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)
Status: Active Update: 13-04-2023 https://echa.europa.eu/registration-dossier/-/registered-dossier/5450
Bis(2-ethylhexyl) amine: Does not have an individual approval but may be used under an appropriate group standard
DOT LabelCorrosive
Fire HazardsThis chemical is combustible. (NTP, 1992)
Health HazardsSYMPTOMS: Symptoms of exposure to this compound may include irritation to the skin and eyes.
Hazards SummaryA skin and eye irritant; A lachrymator; [CAMEO] Toxic by inhalation; Harmful if skin contact or ingested; Causes burns; May cause pneumonitis and pulmonary edema after inhalation of high concentrations; [MSDSonline]
Reactive GroupAmines, Phosphines, and Pyridines
Reactivity Profile
2,2'-DIETHYLHEXYLAMINE can react with oxidizing materials (NTP, 1992). Neutralizes acids in exothermic reactions to form salts plus water. May be incompatible with isocyanates, halogenated organics, peroxides, phenols (acidic), epoxides, anhydrides, and acid halides. Flammable gaseous hydrogen may be generated in combination with strong reducing agents, such as hydrides.
Air and Water ReactionsInsoluble in water.
Hazard Classes and CategoriesAcute Tox. 4 (99.7%)
Safety & protection
Fire FightingFires involving this material can be controlled with a dry chemical, carbon dioxide, or Halon extinguisher. (NTP, 1992)
First Aid
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.
Nonfire Spill Response
SMALL SPILLS AND LEAKAGE: If you spill this chemical, FIRST REMOVE ALL SOURCES OF IGNITION. Then, use absorbent paper to pick up all liquid spill material. Your contaminated clothing and absorbent paper should be sealed in a vapor-tight plastic bag for eventual disposal. Solvent wash all contaminated surfaces with ethanol followed by washing 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.
Isolation and EvacuationExcerpt from ERG Guide 153 [Substances - Toxic and/or Corrosive (Combustible)]:
Personal Protective Equipment (PPE)
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)
Toxicology
Adverse EffectsDermatotoxin - Skin burns.
Toxicity DataLC50 (rat) = 920 mg/m3/4H; [MSDSonline]
Safety data
- PPE
- Faceshields, Gloves, Goggles, type ABEK (EN14387) respirator filter
- wgk
- 2
- tsca
- TSCA listed
- rtecs
- IH6825000
- ridadr
- UN 2735 8/PG 2
- hs_code
- 29211980
- Toxicity
- LD50 orally in Rabbit: 1008 mg/kg LD50 dermal Rabbit 956 mg/kg
- risk_code
- 21/22-34
- Signal word
- Danger
- Symbol(GHS)
- GHS05,GHS06,GHS09
- hazard_code
- C,Xi
- hazard_note
- Irritant/Corrosive
- safety_code
- 26-36/37/39-45-36
- hazard_class
- 8
- Storage Class
- 6.1A - Combustible acute toxic Cat. 1 and 2very toxic hazardous materials
- packing_group
- III
- Hazard statements
- H302-H311+H331-H314-H410
- Limited Quantities
- 1.0 L (0.3 gallons) (liquid) or 1 Kg (2.2 lbs) (solid)
- Excepted Quantities
- Max Inner Pack (30g or 30ml) and Max Outer Pack (500g or 500ml)
- REACH Registrations
- Active
- Hazard Classifications
- Acute Tox. 3 DermalAcute Tox. 3 InhalationAcute Tox. 4 OralAquatic Chronic 1Eye Dam. 1Skin Corr. 1B
- Autoignition Temperature
- 230 °C
- Precautionary statements
- P273-P280-P301+P312-P303+P361+P353-P304+P340+P310-P305+P351+P338
Chemistry & industry
Uses & manufacturing
U.S. Production2023: 100,000 - <250,000 lb
Industry UsesCorrosion inhibitor
Use ClassificationCosmetics -> Antistatic; Hair conditioning
General Manufacturing Information
Petroleum Lubricating Oil and Grease Manufacturing
1-Hexanamine, 2-ethyl-N-(2-ethylhexyl)-: ACTIVE
Applications
UsesBis(2-ethylhexyl)amine (BEA) was used in the synthesis of stable nanosized CdS particles coated by an oriented monolayer of chemically bonded BEA molecules
General DescriptionClear colorless liquid with a slight ammonia-like odor.
Upstream & downstream products
Upstream raw materials
Downstream products
Suppliers50 total
国药集团化学试剂有限公司86-21-63210123 · [email protected]
北京华美互利生物化工010-56205725 · [email protected]
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]
湖北宥澄新材料科技有限公司17764017698 13163370568 · [email protected]
宁波化工原料有限公司13306607903;13306607903 · [email protected]
河北创海生物科技有限公司+86-86-13131129325 · [email protected]
武汉吉业升化工有限公司027-83360216 18040558719 · [email protected]
爱斯特（成都）生物制药股份有限公司+86-28-85122536 85324413 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
Hebei Yanxi Chemical Co., Ltd.+86-17531190177 · [email protected]
Syntechem Co.,Ltd[email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
北京华威锐科化工有限公司0757-86329057 18934348241 · [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]
上海瀚鸿科技股份有限公司021-54306202 13764082696 · [email protected]
上海泰坦科技股份有限公司400-6009262 15618770481 · [email protected]
江苏喜勒能源有限公司15653388333 15653388333 · [email protected]
山东西亚化学有限公司13355009207 13355009207 · [email protected]
玛雅试剂+86 (573) 82222445 (0)18006601000 452520369 · [email protected]
四川库利南科技有限公司400-1166-196 18981987031 · [email protected]
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]
武汉吉业升化工有限公司027-13545242311 13545242311 · [email protected]
斯百全化学（上海）有限公司021-021-021-67601398-809-809-809 15221380277 · [email protected]
艾科试剂4008-755-333 18080918076 · [email protected]
上海思域化工科技有限公司86-21-34053660 · [email protected]
赛默飞世尔科技（中国）有限公司800-810-5118 · [email protected]
北京伊诺凯科技有限公司400-810-7969 010-59572699 · [email protected]
TCI AMERICA800-4238616 · [email protected]
TOKYO CHEMICAL INDUSTRY CO., LTD.03-36680489 · [email protected]
TCI Europe320-37350700 · [email protected]
苏州亚科科技股份有限公司0512-87182055 13451648594 · [email protected]
上海将来实业股份有限公司400-0066400 13621662912 · [email protected]
安徽科迪达化工有限公司0554-2106669 · [email protected]
成都零六生物科技有限公司400-1166-196 13458535857 · [email protected]
上海创赛科技有限公司400-6087598 15021221957 · [email protected]
上海麦克林生化科技股份有限公司15221275939 15221275939 · [email protected]
北京欣赛维化学科技有限公司010-56218822 13717722232 · [email protected]
上海凯赛化工有限公司021-33516722 13701817765 · [email protected]
北京华扬致成科技有限公司13716033033 · [email protected]
上海容立化学科技有限公司021-69992220 13701886816 · [email protected]
湖北巨胜科技有限公司027-59599241 18871490274 · [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]
郑州科豫隆化工产品有限公司17319789407 17319789407 · [email protected]
Alfa Chemistry1-516-6625404 · [email protected]
九鼎化学（上海）科技有限公司4009209199 · [email protected]
尤尼威尔化学品（上海）有限公司021-61932772 13012862996 · [email protected]
Additional notes
DefinitionChEBI: Bis(2-ethylhexyl) amine is a secondary amino compound.
Related reactions
22 records
Linked notes
Loading…