(2-bromo-3,4-dimethylphenyl)methanol

C9H11BrO — CID 66602570

IUPAC(2-bromo-3,4-dimethylphenyl)methanol
SMILESCc1ccc(CO)c(Br)c1C
InChIInChI=1S/C9H11BrO/c1-6-3-4-8(5-11)9(10)7(6)2/h3-4,11H,5H2,1-2H3
InChIKeyIVNMRHCABPFWBC-UHFFFAOYSA-N
MW215.09 g/mol
LogP2.56
Rot. Bonds1

About (2-bromo-3,4-dimethylphenyl)methanol

(2-bromo-3,4-dimethylphenyl)methanol (PubChem CID 66602570) has the molecular formula C9H11BrO and a molecular weight of 215.09 g/mol. Its IUPAC name is (2-bromo-3,4-dimethylphenyl)methanol.

Molecular Properties

Compound Name(2-bromo-3,4-dimethylphenyl)methanol
PubChem CID66602570
Molecular FormulaC9H11BrO
Molecular Weight215.09 g/mol
Exact Mass214.00
IUPAC Name(2-bromo-3,4-dimethylphenyl)methanol
SMILESCc1ccc(CO)c(Br)c1C
InChIInChI=1S/C9H11BrO/c1-6-3-4-8(5-11)9(10)7(6)2/h3-4,11H,5H2,1-2H3
InChIKeyIVNMRHCABPFWBC-UHFFFAOYSA-N
XLogP2.56
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.09
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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2-bromo-3,4-dimethylbenzoic acid
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(3,4-dimethyl-2-nitrophenyl)methanol
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3-(hydroxymethyl)-2,6-dimethylbenzoic acid
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azane;(3,4-dimethyl-2-octylphenyl)methanol
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bis[3-bromo-4-(bromomethyl)-2-methylphenyl]methanone
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(7-methyl-2,3-dihydro-1H-inden-4-yl)methanol
CID 117276140
(2-bromo-4-fluoro-3-methoxyphenyl)methanol
CID 131627994
(2-bromo-4-iodo-3-methoxyphenyl)methanol
CID 171007673
[3,4-dimethyl-2-[(2-methylphenyl)methoxy]phenyl]methanol
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(2-bromo-3-chloro-6-methylphenyl)methanol
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Frequently Asked Questions

What is the IUPAC name of (2-bromo-3,4-dimethylphenyl)methanol?
The IUPAC name of (2-bromo-3,4-dimethylphenyl)methanol (CID 66602570) is (2-bromo-3,4-dimethylphenyl)methanol.
What is the SMILES notation for (2-bromo-3,4-dimethylphenyl)methanol?
The canonical SMILES for (2-bromo-3,4-dimethylphenyl)methanol is Cc1ccc(CO)c(Br)c1C.
What is the InChIKey of (2-bromo-3,4-dimethylphenyl)methanol?
The InChIKey is IVNMRHCABPFWBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11BrO/c1-6-3-4-8(5-11)9(10)7(6)2/h3-4,11H,5H2,1-2H3.
What are the key properties of (2-bromo-3,4-dimethylphenyl)methanol?
(2-bromo-3,4-dimethylphenyl)methanol has a molecular weight of 215.09 g/mol, XLogP of 2.56, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2-bromo-3,4-dimethylphenyl)methanol is sourced from PubChem (CID 66602570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).