Basic information
- CAS
63468-70-2- Standard SMILES
CCCCCCC(N)C#N- InChIKey
CJURZHVBRCKLPN-UHFFFAOYSA-N- Molecular formula
- C8H16N2
- Average molar mass
- 140.23 g/mol
- Monoisotopic mass
- 140.13134852
Names & identifiers
- Preferred name
- Octanenitrile, 2-amino-
- IUPAC
- 2-aminooctanenitrile
- English name
- 2-aminooctanenitrile
- Molecular formula
- C8H16N2
- Molecular weight
- 140.23
Names & synonyms
2-AminooctanenitrileOctanenitrile, 2-amino-EINECS 264-253-0DTXSID70886611RefChem:167788DTXCID501025935264-253-063468-70-2SCHEMBL2375443CJURZHVBRCKLPN-UHFFFAOYSA-NDB-292970NS00054881
Database identifiers
- CAS
63468-70-2- PubChem CID
- 112682
- DTXSID
DTXSID70886611- EC Number
- 264-253-0
- Nikkaji
- J349.237K
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 49.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 112
Physicochemical properties
- EPA Substance Registry System
- 2 · Octanenitrile, 2-amino- (63468-70-2)
- TSCA
- TSCA listed
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationOctanenitrile, 2-amino-: INACTIVE
Suppliers1 total
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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