| CAS Number | 586965-84-6 |
| Catalog Number | AG01A93B |
| Chemical Name | 2-Aminocyclohexane-1-carbonitrile |
| IUPAC Name | 2-aminocyclohexane-1-carbonitrile |
| InChI | InChI=1S/C7H12N2/c8-5-6-3-1-2-4-7(6)9/h6-7H,1-4,9H2 |
| InChI Key | RVGOKHBYNZPVGI-UHFFFAOYSA-N |
| MDL Number | MFCD16860247 |
| Molecular Formula | C7H12N2 |
| Molecular Weight | 124.1836 |
| SMILES | NC1C(CCCC1)C#N |
| Synonyms | 2-Aminocyclohexanecarbonitrile,
2-aminocyclohexane-1-carbonitrile,
586965-84-6,
(1R,2R)-2-aminocyclohexane-1-carbonitrile,
(1S,2R)-2-aminocyclohexane-1-carbonitrile,
rel-(1S,2S)-2-aminocyclohexane-1-carbonitrile,
1127904-48-6,
1127904-57-7,
187610-79-3,
874293-84-2,
(1R,2S)-2-aminocyclohexane-1-carbonitrile,
SCHEMBL11307863,
RVGOKHBYNZPVGI-UHFFFAOYSA-N,
AKOS011791660,
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| Complexity | 133 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 124.1g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 124.187g/mol |
| Monoisotopic Mass | 124.1g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 49.8A^2 |
| Undefined Atom Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number