| CAS Number | 91245-61-3 |
| Catalog Number | AG01A1GY(AGN-PC-03O11Q) |
| Chemical Name | (1-benzylcyclopropyl)methanamine |
| IUPAC Name | (1-benzylcyclopropyl)methanamine |
| InChI | InChI=1S/C11H15N/c12-9-11(6-7-11)8-10-4-2-1-3-5-10/h1-5H,6-9,12H2 |
| InChI Key | MIVHNNWMFIPWIF-UHFFFAOYSA-N |
| MDL Number | MFCD20694299 |
| Molecular Formula | C11H15N |
| Molecular Weight | 161.2435 |
| SMILES | NCC1(CC1)CC1=CC=CC=C1 |
| Synonyms | (1-benzylcyclopropyl)methanamine,
91245-61-3,
SCHEMBL3614196,
ZINC71483004,
AKOS014777743,
MCULE-6531343687,
NE16678,
[1-(Phenylmethyl)cyclopropyl]methanamine,
|
| Complexity | 143 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 161.12g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 161.248g/mol |
| Monoisotopic Mass | 161.12g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 26A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.8 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number