| CAS Number | 921074-63-7 |
| Catalog Number | AG00H1SP(AGN-PC-0WBSBF) |
| Chemical Name | [(2-Fluorophenyl)methyl](propan-2-yl)amine |
| IUPAC Name | N-[(2-fluorophenyl)methyl]propan-2-amine |
| InChI | InChI=1S/C10H14FN/c1-8(2)12-7-9-5-3-4-6-10(9)11/h3-6,8,12H,7H2,1-2H3 |
| InChI Key | KECOIFWUUTVTTN-UHFFFAOYSA-N |
| MDL Number | MFCD08060643 |
| Molecular Formula | C10H14FN |
| Molecular Weight | 167.2233 |
| SMILES | CC(NCC1=C(F)C=CC=C1)C |
| Synonyms | (2-Fluoro-benzyl)-isopropyl-amine,
921074-63-7,
[(2-fluorophenyl)methyl](propan-2-yl)amine,
AC1Q1QC6,
2-Fluoro-N-isopropylbenzylamine,
SCHEMBL12312598,
DTXSID30589338,
MFCD08060643,
ZINC10436209,
AKOS000161092,
MCULE-8881683750,
NE17777,
KS-00001L89,
AM101604,
N-[(2-fluorophenyl)methyl]propan-2-amine,
EN300-32124,
Z86129898,
N-(2-Fluorophenylmethyl)isopropylamine,
|
| Complexity | 125 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 167.111g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 167.227g/mol |
| Monoisotopic Mass | 167.111g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 12A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number