N,N-Dimethylpropanediamine

HCID 169191

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Basic information

CAS: 27174-96-5
Standard SMILES: CCC(N)N(C)C
InChIKey: OOFAEFCMEHZNGP-UHFFFAOYSA-N
Molecular formula: C5H14N2
Average molar mass: 102.18 g/mol
Monoisotopic mass: 102.11569846

Names & identifiers

Preferred name: N,N-Dimethylpropanediamine
IUPAC: 1-N',1-N'-dimethylpropane-1,1-diamine
English name: N,N-dimethylpropanediamine
Molecular formula: C5H14N2
Molecular weight: 102.17806

Names & synonyms

N,N-DimethylpropanediaminePropanediamine, N,N-dimethyl-30734-81-7EINECS 250-315-4RefChem:822638DTXSID001063164250-315-41-N',1-N'-dimethylpropane-1,1-diamineN,N-dimethyl-propanediamineSCHEMBL54993SCHEMBL133716SCHEMBL611505

Show more names

SCHEMBL2782114SCHEMBL8401508DTXSID10949916AKOS006340747N~1~,N~1~-Dimethylpropane-1,1-diamineNS0005087727174-96-5

Database identifiers

CAS: 27174-96-5、30734-81-7
PubChem CID: 169191
DTXSID: DTXSID10949916
EC Number: 250-315-4
Nikkaji: J91.243C

Properties

Computed structural properties

XLogP: 0.4
Topological polar surface area: 29.3 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 2
Rotatable bonds: 2
Heavy atoms: 7
Formal charge: 0
Complexity: 43

Physicochemical properties

EPA Substance Registry System: Propanediamine, N,N-dimethyl- (30734-81-7)
TSCA: TSCA listed

Safety & regulation

GHS classification

GHS ClassificationNot Classified；Reported as not meeting GHS hazard criteria by 1 of 1 companies. For more detailed information, please visit ECHA C&L website.