| CAS Number | 147611-60-7 |
| Catalog Number | AG01BA5J(AGN-PC-0Q0MIN) |
| Chemical Name | 3-amino-3-(3,4-dichlorophenyl)propan-1-ol |
| IUPAC Name | 3-amino-3-(3,4-dichlorophenyl)propan-1-ol |
| InChI | InChI=1S/C9H11Cl2NO/c10-7-2-1-6(5-8(7)11)9(12)3-4-13/h1-2,5,9,13H,3-4,12H2 |
| InChI Key | CFNAMLAVUTUGPM-UHFFFAOYSA-N |
| MDL Number | MFCD03412661 |
| Molecular Formula | C9H11Cl2NO |
| Molecular Weight | 220.0957 |
| SMILES | NC(C1=CC(Cl)=C(Cl)C=C1)CCO |
| Synonyms | 3-Amino-3-(3,4-dichloro-phenyl)-propan-1-ol,
147611-61-8,
3-amino-3-(3,4-dichlorophenyl)propan-1-ol,
(3R)-3-AMINO-3-(3,4-DICHLOROPHENYL)PROPAN-1-OL,
1395407-51-8,
147611-60-7,
SCHEMBL10603418,
CTK4C5486,
DTXSID00588757,
MFCD03412661,
AKOS011674477,
AB14421,
RT-008551,
A57322,
3-AMINO-3- -PROPAN-1-OL,
|
| Complexity | 157 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 219.022g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 220.093g/mol |
| Monoisotopic Mass | 219.022g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 46.2A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number