Basic information
- CAS
20383-23-7- Standard SMILES
CNCCCCN(C)C- InChIKey
UOTKNWSJLVKOJR-UHFFFAOYSA-N- Molecular formula
- C7H18N2
- Average molar mass
- 130.23 g/mol
- Monoisotopic mass
- 130.14699858
Names & identifiers
- Preferred name
- (4-(Dimethylamino)butyl)(methyl)amine
- IUPAC
- N,N',N'-trimethylbutane-1,4-diamine
- English name
- N,N,N'-Trimethyl-1,4-diaminobutane
- Molecular formula
- C7H18N2
- Molecular weight
- 130.23
Names & synonyms
20383-23-7[4-(dimethylamino)butyl](methyl)amineDTXSID50439508(4-(Dimethylamino)butyl)(methyl)amineRefChem:208510DTXCID80390330850-135-1N1,N1,N4-Trimethylbutane-1,4-diamineN,N',N'-trimethylbutane-1,4-diamine1,4-Butanediamine, N1,N1,N4-trimethyl-N,N,N'-Trimethyl-butane-1,4-diamine1,4-Butanediamine, N,N,N'-trimethyl-
Show more names
N,N,N'-trimethyl-1,4-butanediamine4-(dimethylamino)butyl](methyl)amine
SCHEMBL380652SCHEMBL380653SCHEMBL2981012UOTKNWSJLVKOJR-UHFFFAOYSA-NN,N,N'-Trimethyl-1,4-diaminobutaneAKOS008140074EBC-618177N-(4-dimethylaminobutyl)-N-methylamine
Database identifiers
- CAS
20383-23-7- PubChem CID
- 10419213
- DTXSID
DTXSID50439508- EC Number
- 850-135-1
- Nikkaji
- J386.697A
Properties
Computed structural properties
- XLogP
- 0.5
- Topological polar surface area
- 15.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 52.9
Physicochemical properties
- Boiling point
- 165.3 · 165.3±8.0℃ (760 Torr)
- Density
- 0.813 · 0.813±0.06 g/cm3 (20 ºC 760 Torr)
- Flash point
- 42.4 · 42.4±9.4℃
- pka
- 10.67 · 10.67±0.10(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319
- Precautionary statements
- 264 · P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Danger
H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]
P210, P233, P240, P241, P242, P243, P260, P261, P264, P270, P271, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P317, P319, P321, P330, P362+P364, P363, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesFlam. Liq. 3 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H315-H319
- Precautionary statements
- P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313
Chemistry & industry
Suppliers7 total
阳谷荣科商贸有限公司15863541132 · [email protected]
江苏艾康生物医药研发有限公司025-66028182 17714375163 · [email protected]
菏泽星达医药科技有限公司13583079096 · [email protected]
上海慧慈医药科技有限公司133-31922809 19372841038 · [email protected]
砌块化学科技（上海）有限公司021-20432219 13918097649 · [email protected]
上海智乾生物科技有限公司[email protected]
山东煜昌药业有限公司531-87153728 13805401165 · [email protected]
Related reactions
2 records
Compound notes
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