(2-chloro-4-fluoro-3-methoxyphenyl)methanol

C8H8ClFO2 — CID 171005170

IUPAC(2-chloro-4-fluoro-3-methoxyphenyl)methanol
SMILESCOc1c(F)ccc(CO)c1Cl
InChIInChI=1S/C8H8ClFO2/c1-12-8-6(10)3-2-5(4-11)7(8)9/h2-3,11H,4H2,1H3
InChIKeyZPADKVGTPXBSTO-UHFFFAOYSA-N
MW190.60 g/mol
LogP1.98
Rot. Bonds2

About (2-chloro-4-fluoro-3-methoxyphenyl)methanol

(2-chloro-4-fluoro-3-methoxyphenyl)methanol (PubChem CID 171005170) has the molecular formula C8H8ClFO2 and a molecular weight of 190.60 g/mol. Its IUPAC name is (2-chloro-4-fluoro-3-methoxyphenyl)methanol.

Molecular Properties

Compound Name(2-chloro-4-fluoro-3-methoxyphenyl)methanol
PubChem CID171005170
Molecular FormulaC8H8ClFO2
Molecular Weight190.60 g/mol
Exact Mass190.02
IUPAC Name(2-chloro-4-fluoro-3-methoxyphenyl)methanol
SMILESCOc1c(F)ccc(CO)c1Cl
InChIInChI=1S/C8H8ClFO2/c1-12-8-6(10)3-2-5(4-11)7(8)9/h2-3,11H,4H2,1H3
InChIKeyZPADKVGTPXBSTO-UHFFFAOYSA-N
XLogP1.98
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.60
LogP ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2-chloro-4-fluoro-3-methoxyphenyl)propan-2-one
CID 54232083
3-fluoro-6-(hydroxymethyl)-2-methoxyphenol
CID 84654293
(2-bromo-4-fluoro-3-methoxyphenyl)methanol
CID 131627994
6-fluoro-3-(hydroxymethyl)-2-methoxyphenol
CID 117276907
(4-chloro-2,3-dimethoxyphenyl)methanol
CID 84671127
(3-chloro-2-fluoro-4-methoxyphenyl)methanol
CID 84662935
2-chloro-4-fluoro-3-methoxybenzamide
CID 163198226
3-fluoro-6-(3-hydroxypropyl)-2-methoxyphenol
CID 117289242
4-(3-chloro-4-fluoro-2-methoxyphenyl)butanoic acid
CID 117369147
2-chloro-N,N-diethyl-4-fluoro-3-methoxybenzamide
CID 162421154
(3-chloro-2-methoxyphenyl)methanol
CID 54184130
(3,4-difluoro-2-iodophenyl)methanol
CID 137378555

Frequently Asked Questions

What is the IUPAC name of (2-chloro-4-fluoro-3-methoxyphenyl)methanol?
The IUPAC name of (2-chloro-4-fluoro-3-methoxyphenyl)methanol (CID 171005170) is (2-chloro-4-fluoro-3-methoxyphenyl)methanol.
What is the SMILES notation for (2-chloro-4-fluoro-3-methoxyphenyl)methanol?
The canonical SMILES for (2-chloro-4-fluoro-3-methoxyphenyl)methanol is COc1c(F)ccc(CO)c1Cl.
What is the InChIKey of (2-chloro-4-fluoro-3-methoxyphenyl)methanol?
The InChIKey is ZPADKVGTPXBSTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8ClFO2/c1-12-8-6(10)3-2-5(4-11)7(8)9/h2-3,11H,4H2,1H3.
What are the key properties of (2-chloro-4-fluoro-3-methoxyphenyl)methanol?
(2-chloro-4-fluoro-3-methoxyphenyl)methanol has a molecular weight of 190.60 g/mol, XLogP of 1.98, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-chloro-4-fluoro-3-methoxyphenyl)methanol is sourced from PubChem (CID 171005170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).