(2-bromo-3-methoxyphenyl)methanol

C8H9BrO2 — CID 54103130

IUPAC(2-bromo-3-methoxyphenyl)methanol
SMILESCOc1cccc(CO)c1Br
InChIInChI=1S/C8H9BrO2/c1-11-7-4-2-3-6(5-10)8(7)9/h2-4,10H,5H2,1H3
InChIKeyUYNFEAWRYONGMV-UHFFFAOYSA-N
MW217.06 g/mol
LogP1.95
Rot. Bonds2

About (2-bromo-3-methoxyphenyl)methanol

(2-bromo-3-methoxyphenyl)methanol (PubChem CID 54103130) has the molecular formula C8H9BrO2 and a molecular weight of 217.06 g/mol. Its IUPAC name is (2-bromo-3-methoxyphenyl)methanol.

Molecular Properties

Compound Name(2-bromo-3-methoxyphenyl)methanol
PubChem CID54103130
Molecular FormulaC8H9BrO2
Molecular Weight217.06 g/mol
Exact Mass215.98
IUPAC Name(2-bromo-3-methoxyphenyl)methanol
SMILESCOc1cccc(CO)c1Br
InChIInChI=1S/C8H9BrO2/c1-11-7-4-2-3-6(5-10)8(7)9/h2-4,10H,5H2,1H3
InChIKeyUYNFEAWRYONGMV-UHFFFAOYSA-N
XLogP1.95
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.06
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (2-bromo-3-methoxyphenyl)methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[(2-bromo-3-methoxyphenyl)methyl]hydroxylamine
CID 117335656
(2-(111C)methoxyphenyl)methanol
CID 59897789
(2-bromo-3-propoxyphenyl)methanol
CID 118270127
2-(2-bromo-3-methoxyphenyl)ethanamine
CID 83711367
2-amino-3-(2-bromo-3-methoxyphenyl)-2-methylpropan-1-ol
CID 164664029
2-bromo-1-(3-bromopropyl)-3-methoxybenzene
CID 119022579
1-(2-bromo-3-methoxyphenyl)-N-methylpropan-2-amine
CID 84738148
1,2-dibromo-3-methoxybenzene
CID 11958056
[2-[2-(dimethylamino)ethoxy]-3-methoxyphenyl]methanol
CID 43471611
(3-bromo-7-methoxy-1-methylindol-2-yl)methanol
CID 115050313
(1,5-dimethoxynaphthalen-2-yl)methanol
CID 117310761
(3-methoxy-2-pentan-2-yloxyphenyl)methanol
CID 107892192

Frequently Asked Questions

What is the IUPAC name of (2-bromo-3-methoxyphenyl)methanol?
The IUPAC name of (2-bromo-3-methoxyphenyl)methanol (CID 54103130) is (2-bromo-3-methoxyphenyl)methanol.
What is the SMILES notation for (2-bromo-3-methoxyphenyl)methanol?
The canonical SMILES for (2-bromo-3-methoxyphenyl)methanol is COc1cccc(CO)c1Br.
What is the InChIKey of (2-bromo-3-methoxyphenyl)methanol?
The InChIKey is UYNFEAWRYONGMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9BrO2/c1-11-7-4-2-3-6(5-10)8(7)9/h2-4,10H,5H2,1H3.
What are the key properties of (2-bromo-3-methoxyphenyl)methanol?
(2-bromo-3-methoxyphenyl)methanol has a molecular weight of 217.06 g/mol, XLogP of 1.95, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-bromo-3-methoxyphenyl)methanol is sourced from PubChem (CID 54103130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).