| CAS Number | 675575-45-8 |
| Catalog Number | AG005MN8(AGN-PC-05DWZM) |
| Chemical Name | 2-(Cyclopropylamino)benzonitrile |
| IUPAC Name | 2-(cyclopropylamino)benzonitrile |
| InChI | InChI=1S/C10H10N2/c11-7-8-3-1-2-4-10(8)12-9-5-6-9/h1-4,9,12H,5-6H2 |
| InChI Key | SAEMCVCVAUDVNV-UHFFFAOYSA-N |
| MDL Number | MFCD11155689 |
| Molecular Formula | C10H10N2 |
| Molecular Weight | 158.1998 |
| SMILES | N#Cc1ccccc1NC1CC1 |
| Synonyms | 2-(Cyclopropylamino)benzonitrile,
675575-45-8,
ACMC-209nzy,
CTK8B2141,
DTXSID50651521,
ANW-35372,
MFCD11155689,
ZINC20076019,
AKOS000260963,
AJ-76005,
CJ-16539,
TC-124117,
ST24021865,
V7238,
B-9191,
C10H10N2,
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| Complexity | 199 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 158.084g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 158.204g/mol |
| Monoisotopic Mass | 158.084g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 35.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.7 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number