(4-chlorophenyl)-thiophen-2-ylmethanol

C11H9ClOS — CID 10242757

IUPAC(4-chlorophenyl)-thiophen-2-ylmethanol
SMILESOC(c1ccc(Cl)cc1)c1cccs1
InChIInChI=1S/C11H9ClOS/c12-9-5-3-8(4-6-9)11(13)10-2-1-7-14-10/h1-7,11,13H
InChIKeyLJVKWISXJUROPV-UHFFFAOYSA-N
MW224.71 g/mol
LogP3.48
Rot. Bonds2

About (4-chlorophenyl)-thiophen-2-ylmethanol

(4-chlorophenyl)-thiophen-2-ylmethanol (PubChem CID 10242757) has the molecular formula C11H9ClOS and a molecular weight of 224.71 g/mol. Its IUPAC name is (4-chlorophenyl)-thiophen-2-ylmethanol.

Molecular Properties

Compound Name(4-chlorophenyl)-thiophen-2-ylmethanol
PubChem CID10242757
Molecular FormulaC11H9ClOS
Molecular Weight224.71 g/mol
Exact Mass224.01
IUPAC Name(4-chlorophenyl)-thiophen-2-ylmethanol
SMILESOC(c1ccc(Cl)cc1)c1cccs1
InChIInChI=1S/C11H9ClOS/c12-9-5-3-8(4-6-9)11(13)10-2-1-7-14-10/h1-7,11,13H
InChIKeyLJVKWISXJUROPV-UHFFFAOYSA-N
XLogP3.48
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.71
LogP ≤ 53.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-Chlorobenzo[b]thiophene-3-methanol
CID 2776136
Phenyl(2-thienyl)methanol
CID 2741016
3-(3-Chlorophenyl)-1-(2-thienyl)-1-propanol
CID 2768269
5-(4-Chlorophenyl)thien-2-ylglycolic acid
CID 23332056
(2-(Thiophen-2-yl)phenyl)methanol
CID 2795559
(1R,2S)-2-(4-chlorophenyl)sulfanyl-1-phenylpropan-1-ol
CID 44436340
4-(4-Chlorophenyl)-5-(hydroxymethyl)-2-propan-2-ylsulfanylthiophene-3-carbonitrile
CID 44480693
(3-Chloro-1-benzothien-2-yl)methanol
CID 821965
1-Phenyl-3-(2-thienyl)-2-propyn-1-ol
CID 15829074
(4-Fluorophenyl)(2-thienyl)methanol
CID 10987480
[5-(4-Chlorophenyl)-4-(4-fluorophenyl)-2-propan-2-ylthiophen-3-yl]methanol
CID 11121971
2-(4-Chlorophenyl)sulfanyl-1-(4-fluorophenyl)ethanol
CID 60714806

Frequently Asked Questions

What is the IUPAC name of (4-chlorophenyl)-thiophen-2-ylmethanol?
The IUPAC name of (4-chlorophenyl)-thiophen-2-ylmethanol (CID 10242757) is (4-chlorophenyl)-thiophen-2-ylmethanol.
What is the SMILES notation for (4-chlorophenyl)-thiophen-2-ylmethanol?
The canonical SMILES for (4-chlorophenyl)-thiophen-2-ylmethanol is OC(c1ccc(Cl)cc1)c1cccs1.
What is the InChIKey of (4-chlorophenyl)-thiophen-2-ylmethanol?
The InChIKey is LJVKWISXJUROPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9ClOS/c12-9-5-3-8(4-6-9)11(13)10-2-1-7-14-10/h1-7,11,13H.
What are the key properties of (4-chlorophenyl)-thiophen-2-ylmethanol?
(4-chlorophenyl)-thiophen-2-ylmethanol has a molecular weight of 224.71 g/mol, XLogP of 3.48, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-chlorophenyl)-thiophen-2-ylmethanol is sourced from PubChem (CID 10242757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).