| CAS Number | 4771-81-7 |
| Catalog Number | AG00D8XH(AGN-PC-094K33) |
| Chemical Name | Cyclohex-3-enecarboxamide |
| IUPAC Name | cyclohex-3-ene-1-carboxamide |
| InChI | InChI=1S/C7H11NO/c8-7(9)6-4-2-1-3-5-6/h1-2,6H,3-5H2,(H2,8,9) |
| InChI Key | VSCLUBLXOWRBCQ-UHFFFAOYSA-N |
| MDL Number | MFCD00218754 |
| Molecular Formula | C7H11NO |
| Molecular Weight | 125.1683 |
| NSC Number | 176944 |
| SMILES | NC(C1CC=CCC1)=O |
| Synonyms | cyclohex-3-ene-1-carboxamide,
4771-81-7,
cyclohex-3-enecarboxamide,
3-Cyclohexene-1-carboxamide,
NSC176944,
AC1L6XIF,
SCHEMBL4612793,
CTK4J0204,
DTXSID40306492,
cyclohex-3-enecarboxylic acid amide,
(1R)-Cyclohex-3-ene-1-carboxamide,
SBB056263,
AKOS006243118,
NSC-176944,
DB-070846,
FT-0730839,
771C817,
2165903-49-9,
CID301015,
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| Complexity | 140 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 125.084g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 125.171g/mol |
| Monoisotopic Mass | 125.084g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 43.1A^2 |
| Undefined Atom Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.6 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number