Basic information
- CAS
68649-56-9- Standard SMILES
C=C(C)C.CN(C)CCCN- InChIKey
STOVGTNLKYXCKG-UHFFFAOYSA-N- Molecular formula
- C9H22N2
- Average molar mass
- 158.28 g/mol
- Monoisotopic mass
- 158.1782987
Names & identifiers
- Preferred name
- N~1~,N~1~-Dimethylpropane-1,3-diamine--2-methylprop-1-ene (1/1)
- IUPAC
- N',N'-dimethylpropane-1,3-diamine;2-methylprop-1-ene
- English name
- 1,3-Propanediamine, N,N-diethyl-, reaction product with chlorinatedpolyisobutylene
- Molecular formula
- C9H22N2
- Molecular weight
- 158.28438
Names & synonyms
SCHEMBL9483431DTXSID60988335N~1~,N~1~-Dimethylpropane-1,3-diamine--2-methylprop-1-ene (1/1)68649-56-91,3-Propanediamine, N,N-diethyl-, reaction product with chlorinatedpolyisobutylene1,3-Propanediamine, N,N-dimethyl-, reaction product with chlorinated polyisobutylene1,3-Propanediamine, N,N-dimethyl-, reaction products with chlorinated polyisobutylene
Database identifiers
- CAS
68649-56-9、98761-78-5- PubChem CID
- 160336
- DTXSID
DTXSID60988335
Properties
Computed structural properties
- Topological polar surface area
- 29.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 58.1
Physicochemical properties
- EPA Substance Registry System
- 1 · 1,3-Propanediamine, N,N-dimethyl-, reaction products with chlorinated polyisobutylene (98761-78-5)
- TSCA
- TSCA listed
Safety & regulation
Safety data
- tsca
- TSCA listed
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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