[2-chloro-6-(4-methylphenyl)sulfanylphenyl]methanol

C14H13ClOS — CID 55240222

IUPAC[2-chloro-6-(4-methylphenyl)sulfanylphenyl]methanol
SMILESCc1ccc(Sc2cccc(Cl)c2CO)cc1
InChIInChI=1S/C14H13ClOS/c1-10-5-7-11(8-6-10)17-14-4-2-3-13(15)12(14)9-16/h2-8,16H,9H2,1H3
InChIKeyPEFKNVZZGDUTJC-UHFFFAOYSA-N
MW264.78 g/mol
LogP4.29
Rot. Bonds3

About [2-chloro-6-(4-methylphenyl)sulfanylphenyl]methanol

[2-chloro-6-(4-methylphenyl)sulfanylphenyl]methanol (PubChem CID 55240222) has the molecular formula C14H13ClOS and a molecular weight of 264.78 g/mol. Its IUPAC name is [2-chloro-6-(4-methylphenyl)sulfanylphenyl]methanol.

Molecular Properties

Compound Name[2-chloro-6-(4-methylphenyl)sulfanylphenyl]methanol
PubChem CID55240222
Molecular FormulaC14H13ClOS
Molecular Weight264.78 g/mol
Exact Mass264.04
IUPAC Name[2-chloro-6-(4-methylphenyl)sulfanylphenyl]methanol
SMILESCc1ccc(Sc2cccc(Cl)c2CO)cc1
InChIInChI=1S/C14H13ClOS/c1-10-5-7-11(8-6-10)17-14-4-2-3-13(15)12(14)9-16/h2-8,16H,9H2,1H3
InChIKeyPEFKNVZZGDUTJC-UHFFFAOYSA-N
XLogP4.29
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.78
LogP ≤ 54.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[2-chloro-6-(3-methylphenyl)sulfanylphenyl]methanol
CID 63835095
1-[2-chloro-6-(4-methylphenyl)sulfanylphenyl]propan-2-amine
CID 63818585
[2-chloro-6-(3,4-difluorophenyl)sulfanylphenyl]methanol
CID 63814768
[2-(2-bromophenyl)sulfanyl-6-chlorophenyl]methanol
CID 63813275
[2-chloro-6-(2-methoxyphenyl)sulfanylphenyl]methanol
CID 63835528
[2-chloro-6-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]phenyl]methanol
CID 63836193
1-[2-chloro-6-(4-chlorophenyl)sulfanylphenyl]propan-2-amine
CID 63819430
2-[2-(4-tert-butylphenyl)sulfanyl-6-chlorophenyl]ethanamine
CID 63819658
(2-chloro-6-pyrimidin-4-ylsulfanylphenyl)methanol
CID 63835182
2-[2-(4-methylphenyl)sulfanylphenyl]acetic acid
CID 10706368
2-[2-chloro-6-(3,4-dimethylphenyl)sulfanylphenyl]ethanamine
CID 63820479
3-(2,6-dichlorophenyl)-2-(4-methylphenyl)propan-1-ol
CID 79435910

Frequently Asked Questions

What is the IUPAC name of [2-chloro-6-(4-methylphenyl)sulfanylphenyl]methanol?
The IUPAC name of [2-chloro-6-(4-methylphenyl)sulfanylphenyl]methanol (CID 55240222) is [2-chloro-6-(4-methylphenyl)sulfanylphenyl]methanol.
What is the SMILES notation for [2-chloro-6-(4-methylphenyl)sulfanylphenyl]methanol?
The canonical SMILES for [2-chloro-6-(4-methylphenyl)sulfanylphenyl]methanol is Cc1ccc(Sc2cccc(Cl)c2CO)cc1.
What is the InChIKey of [2-chloro-6-(4-methylphenyl)sulfanylphenyl]methanol?
The InChIKey is PEFKNVZZGDUTJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13ClOS/c1-10-5-7-11(8-6-10)17-14-4-2-3-13(15)12(14)9-16/h2-8,16H,9H2,1H3.
What are the key properties of [2-chloro-6-(4-methylphenyl)sulfanylphenyl]methanol?
[2-chloro-6-(4-methylphenyl)sulfanylphenyl]methanol has a molecular weight of 264.78 g/mol, XLogP of 4.29, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-chloro-6-(4-methylphenyl)sulfanylphenyl]methanol is sourced from PubChem (CID 55240222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).