| CAS Number | 101946-36-5 |
| Catalog Number | AG00949B(AGN-PC-0JY41C) |
| Chemical Name | N-(3-cyanophenyl)cyclopropanecarboxamide |
| IUPAC Name | N-(3-cyanophenyl)cyclopropanecarboxamide |
| InChI | InChI=1S/C11H10N2O/c12-7-8-2-1-3-10(6-8)13-11(14)9-4-5-9/h1-3,6,9H,4-5H2,(H,13,14) |
| InChI Key | BCHFMLACFKFMDN-UHFFFAOYSA-N |
| MDL Number | MFCD03159449 |
| Molecular Formula | C11H10N2O |
| Molecular Weight | 186.2099 |
| SMILES | O=C(C1CC1)NC1=CC(C#N)=CC=C1 |
| Synonyms | N-(3-cyanophenyl)cyclopropanecarboxamide,
101946-36-5,
AC1LJGM5,
AC1Q5LJ2,
Oprea1_043543,
SCHEMBL4599396,
CTK7C8523,
BCHFMLACFKFMDN-UHFFFAOYSA-N,
ZINC512444,
AKOS000199816,
MCULE-7694791375,
N-(3-cyanophenyl)cyclopropylcarboxamide,
ST51029933,
EN300-24363,
CID923385,
ZINC00512444,
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| Complexity | 274 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 186.079g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 186.214g/mol |
| Monoisotopic Mass | 186.079g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 52.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.7 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number