4HR
Summary
Name: | (2-bromophenyl)methanol |
Formula: | C7 H7 Br O |
Formal charge: | 0 |
Formula weight: | 187.034 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 12.01 | (2-bromophenyl)methanol |
OpenEye OEToolkits | 1.9.2 | (2-bromophenyl)methanol |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | c1(CO)ccccc1Br |
InChI | InChI | 1.03 | InChI=1S/C7H7BrO/c8-7-4-2-1-3-6(7)5-9/h1-4,9H,5H2 |
InChIKey | InChI | 1.03 | IOWGHQGLUMEZKG-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | OCc1ccccc1Br |
SMILES | CACTVS | 3.385 | OCc1ccccc1Br |
SMILES_CANONICAL | OpenEye OEToolkits | 1.9.2 | c1ccc(c(c1)CO)Br |
SMILES | OpenEye OEToolkits | 1.9.2 | c1ccc(c(c1)CO)Br |