| CAS Number | 74532-85-7 |
| Catalog Number | AG00FGL5(AGN-PC-0U5H0R) |
| Chemical Name | 1-(2-BROMOPHENYL)PROPAN-1-OL |
| IUPAC Name | 1-(2-bromophenyl)propan-1-ol |
| InChI | InChI=1S/C9H11BrO/c1-2-9(11)7-5-3-4-6-8(7)10/h3-6,9,11H,2H2,1H3 |
| InChI Key | SMYHFDLFOKKDOO-UHFFFAOYSA-N |
| MDL Number | MFCD16083358 |
| Molecular Formula | C9H11BrO |
| Molecular Weight | 215.087 |
| SMILES | CCC(C1=C(Br)C=CC=C1)O |
| Synonyms | 1-(2-bromophenyl)-1-propanol,
1-(2-bromophenyl)propan-1-ol,
74532-85-7,
1(2-bromophenyl)propanol,
1-(2-bromophenyl)propanol,
SCHEMBL6625584,
CTK6C8440,
SMYHFDLFOKKDOO-UHFFFAOYSA-N,
(R)-1-(2-broMophenyl)propan-1-ol,
AKOS010995367,
2-BROMO-ALPHA-ETHYLBENZYL ALCOHOL,
4-(but-1-en-1-yl)bromobenzene,
|
| Complexity | 116 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 213.999g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 215.09g/mol |
| Monoisotopic Mass | 213.999g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 20.2A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number