(2,4,6-trichloro-3-methoxyphenyl)methanol

C8H7Cl3O2 — CID 164891467

IUPAC(2,4,6-trichloro-3-methoxyphenyl)methanol
SMILESCOc1c(Cl)cc(Cl)c(CO)c1Cl
InChIInChI=1S/C8H7Cl3O2/c1-13-8-6(10)2-5(9)4(3-12)7(8)11/h2,12H,3H2,1H3
InChIKeyXQMBHUZJBQDROV-UHFFFAOYSA-N
MW241.50 g/mol
LogP3.15
Rot. Bonds2

About (2,4,6-trichloro-3-methoxyphenyl)methanol

(2,4,6-trichloro-3-methoxyphenyl)methanol (PubChem CID 164891467) has the molecular formula C8H7Cl3O2 and a molecular weight of 241.50 g/mol. Its IUPAC name is (2,4,6-trichloro-3-methoxyphenyl)methanol.

Molecular Properties

Compound Name(2,4,6-trichloro-3-methoxyphenyl)methanol
PubChem CID164891467
Molecular FormulaC8H7Cl3O2
Molecular Weight241.50 g/mol
Exact Mass239.95
IUPAC Name(2,4,6-trichloro-3-methoxyphenyl)methanol
SMILESCOc1c(Cl)cc(Cl)c(CO)c1Cl
InChIInChI=1S/C8H7Cl3O2/c1-13-8-6(10)2-5(9)4(3-12)7(8)11/h2,12H,3H2,1H3
InChIKeyXQMBHUZJBQDROV-UHFFFAOYSA-N
XLogP3.15
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.50
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(5-chloro-3,4-dimethoxy-2-methylphenyl)methanol
CID 84682296
(2,3,5-trichloro-6-methoxyphenyl)methanamine;hydrochloride
CID 12761789
1,5-dichloro-2,4-dimethoxy-3-methylbenzene
CID 58961638
(2,3-dichloro-6-methoxyphenyl)methanol
CID 130133361
[2-(hydroxymethyl)-3,4,5-trimethoxyphenyl]methanol
CID 71399833
3-(6-chloro-2-ethyl-3,4-dimethoxyphenyl)propan-1-ol
CID 117400668
tris(2,3,5-trichloro-6-methoxyphenyl)borane
CID 87743306
(2,3-dimethoxy-4,6-dimethylphenyl)methanol
CID 84666963
(6-chloro-7-methoxy-1-methyl-3,4-dihydro-2H-quinolin-8-yl)methanol
CID 177336713
[6-chloro-2-methoxy-3-(trifluoromethyl)phenyl]methanol
CID 171003011
(4-chloro-2-methoxy-3,5-dimethylphenyl)methanol
CID 84669757
3-(aminomethyl)-2,5-dichloro-4-methoxyaniline
CID 23346999

Frequently Asked Questions

What is the IUPAC name of (2,4,6-trichloro-3-methoxyphenyl)methanol?
The IUPAC name of (2,4,6-trichloro-3-methoxyphenyl)methanol (CID 164891467) is (2,4,6-trichloro-3-methoxyphenyl)methanol.
What is the SMILES notation for (2,4,6-trichloro-3-methoxyphenyl)methanol?
The canonical SMILES for (2,4,6-trichloro-3-methoxyphenyl)methanol is COc1c(Cl)cc(Cl)c(CO)c1Cl.
What is the InChIKey of (2,4,6-trichloro-3-methoxyphenyl)methanol?
The InChIKey is XQMBHUZJBQDROV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7Cl3O2/c1-13-8-6(10)2-5(9)4(3-12)7(8)11/h2,12H,3H2,1H3.
What are the key properties of (2,4,6-trichloro-3-methoxyphenyl)methanol?
(2,4,6-trichloro-3-methoxyphenyl)methanol has a molecular weight of 241.50 g/mol, XLogP of 3.15, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2,4,6-trichloro-3-methoxyphenyl)methanol is sourced from PubChem (CID 164891467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).