| CAS Number | 1019532-08-1 |
| Catalog Number | AG00JTSY(AGN-PC-0WOOLT) |
| Chemical Name | [(2-bromophenyl)methyl](2-methylpropyl)amine |
| IUPAC Name | N-[(2-bromophenyl)methyl]-2-methylpropan-1-amine |
| InChI | InChI=1S/C11H16BrN/c1-9(2)7-13-8-10-5-3-4-6-11(10)12/h3-6,9,13H,7-8H2,1-2H3 |
| InChI Key | ORZZHXXYUMBVET-UHFFFAOYSA-N |
| MDL Number | MFCD11139786 |
| Molecular Formula | C11H16BrN |
| Molecular Weight | 242.1554 |
| SMILES | CC(CNCC1=C(Br)C=CC=C1)C |
| Synonyms | [(2-bromophenyl)methyl](2-methylpropyl)amine,
1019532-08-1,
KS-00001LTF,
MFCD11139786,
ZINC19883287,
AKOS000227044,
MCULE-8886174308,
NE26392,
Z86135919,
|
| Complexity | 136 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 241.047g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 242.16g/mol |
| Monoisotopic Mass | 241.047g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 12A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number