Basic information
- CAS
63732-18-3- Standard SMILES
CCC(N)CN(C)C- InChIKey
AKRUIVSMWDCKNI-UHFFFAOYSA-N- Molecular formula
- C6H16N2
- Average molar mass
- 116.2 g/mol
- Monoisotopic mass
- 116.13134852
Names & identifiers
- Preferred name
- N~1~,N~1~-Dimethylbutane-1,2-diamine
- IUPAC
- 1-N,1-N-dimethylbutane-1,2-diamine
Names & synonyms
63732-18-3DTXSID30980200N~1~,N~1~-Dimethylbutane-1,2-diamineRefChem:1093383DTXCID50140747874247-34-0(2-AMINOBUTYL)DIMETHYLAMINEN1,N1-Dimethylbutane-1,2-diamineN,N-Dimethyl-1,2-butanediamine1-N,1-N-dimethylbutane-1,2-diamineMFCD01740933BRN 2069349
Show more names
1,2-Diaminobutane, N,N-dimethyl-1,2-BUTANEDIAMINE, 1-(N,N-DIMETHYL)-SCHEMBL540971SCHEMBL17292911YBD26895AKOS002670498AKOS016045210BS-38416
Database identifiers
- CAS
63732-18-3- PubChem CID
- 44652
- DTXSID
DTXSID30980200- Nikkaji
- J64.618K
Properties
Computed structural properties
- XLogP
- 0.3
- Topological polar surface area
- 29.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 52.5
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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