Basic information
- CAS
16688-98-5- Standard SMILES
Cl.N#CCCNCCC#N- InChIKey
OORIBFQBJDBZCR-UHFFFAOYSA-N- Molecular formula
- C6H10ClN3
- Average molar mass
- 159.62 g/mol
- Monoisotopic mass
- 159.056325
Names & identifiers
- Preferred name
- 3-(2-Cyanoethylamino)propanenitrile;hydrochloride
- IUPAC
- 3-(2-cyanoethylamino)propanenitrile;hydrochloride
- English name
- 3-(2-cyanoethylamino)propanenitrile
- Molecular formula
- C6H9N3
- Molecular weight
- 0
Names & synonyms
16688-98-5NSC 146564AGN-PC-0JS8SL3-(2-cyanoethylamino)propanenitrile;hydrochlorideDTXSID50333956NSC1465643,3'-Iminodipropionitril-hydrochloridNSC-146564NS000763293,3'-Azanediyldipropanenitrile--hydrogen chloride (1/1)3-(2-cyanoethylamino)propanenitrile
Database identifiers
- CAS
16688-98-5- PubChem CID
- 519293
- DTXSID
DTXSID50333956
Properties
Computed structural properties
- Topological polar surface area
- 59.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 126
Chemistry & industry
Suppliers2 total
HONEST JOY HOLDINGS LIMITED[email protected]
UKRORGSYN-BB[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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