| CAS Number | 1094324-01-2 |
| Catalog Number | AG019X1B(AGN-PC-0WODNY) |
| Chemical Name | 1-N-(Cyclopropylmethyl)benzene-1,3-diamine |
| IUPAC Name | 3-N-(cyclopropylmethyl)benzene-1,3-diamine |
| InChI | InChI=1S/C10H14N2/c11-9-2-1-3-10(6-9)12-7-8-4-5-8/h1-3,6,8,12H,4-5,7,11H2 |
| InChI Key | LAWDPLXUOTYGMW-UHFFFAOYSA-N |
| MDL Number | MFCD11132711 |
| Molecular Formula | C10H14N2 |
| Molecular Weight | 162.2316 |
| SMILES | NC1=CC(NCC2CC2)=CC=C1 |
| Synonyms | 1-N-(cyclopropylmethyl)benzene-1,3-diamine,
1094324-01-2,
N1-(cyclopropylmethyl)benzene-1,3-diamine,
ZINC36720309,
AKOS009290288,
MCULE-2788233688,
NE22919,
EN300-53769,
Z1262237332,
|
| Complexity | 143 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 162.116g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 162.236g/mol |
| Monoisotopic Mass | 162.116g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 38A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number