Basic information
- CAS
5350-67-4- Standard SMILES
CC(C#N)N(C)C- InChIKey
GQJKKKULUSFWSC-UHFFFAOYSA-N- Molecular formula
- C5H10N2
- Average molar mass
- 98.15 g/mol
- Monoisotopic mass
- 98.08439833
Names & identifiers
- Preferred name
- 2-(Dimethylamino)propanenitrile
- IUPAC
- 2-(dimethylamino)propanenitrile
- English name
- alpha-Dimethylaminopropionitrile
- Molecular formula
- C5H10N2
- Molecular weight
- 98.15
Names & synonyms
2-(dimethylamino)propanenitrile5350-67-46E3RYM5XQQDTXSID90276939RefChem:1061810DTXCID90228099Propanenitrile, 2-(dimethylamino)-MFCD00045618NSC-53NSC53alpha-DIMETHYLAMINOPROPIONITRILE2-Dimethylaminopropanenitrile
Show more names
SCHEMBL109553SCHEMBL5342459GQJKKKULUSFWSC-UHFFFAOYSA-alpha-(Dimethylamino)propionitrileGQJKKKULUSFWSC-UHFFFAOYSA-NPropionitrile, 2-(dimethylamino)-ALBB-018615AR-1J0331
Database identifiers
- CAS
5350-67-4- PubChem CID
- 219145
- DTXSID
DTXSID90276939- UNII
- 6E3RYM5XQQ
- Nikkaji
- J134.527C
Properties
Computed structural properties
- XLogP
- 0.5
- Topological polar surface area
- 27 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 7
- Formal charge
- 0
- Complexity
- 87
Physicochemical properties
- FDA UNII
- 6 E3RYM5XQQ · 6E3RYM5XQQ
Chemistry & industry
Suppliers2 total
陕西缔都医药化工有限公司+86-29-87569266 +86-17392581500 · [email protected]
南京世洲生物科技有限公司025-85563444 15850508050 · [email protected]
Related reactions
1 records
Compound notes
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