(5-chlorothiophen-2-yl)-thiophen-2-ylmethanol

C9H7ClOS2 — CID 43234424

IUPAC(5-chlorothiophen-2-yl)-thiophen-2-ylmethanol
SMILESOC(c1cccs1)c1ccc(Cl)s1
InChIInChI=1S/C9H7ClOS2/c10-8-4-3-7(13-8)9(11)6-2-1-5-12-6/h1-5,9,11H
InChIKeyKYPSMXWOSDXZDK-UHFFFAOYSA-N
MW230.74 g/mol
LogP3.54
Rot. Bonds2

About (5-chlorothiophen-2-yl)-thiophen-2-ylmethanol

(5-chlorothiophen-2-yl)-thiophen-2-ylmethanol (PubChem CID 43234424) has the molecular formula C9H7ClOS2 and a molecular weight of 230.74 g/mol. Its IUPAC name is (5-chlorothiophen-2-yl)-thiophen-2-ylmethanol.

Molecular Properties

Compound Name(5-chlorothiophen-2-yl)-thiophen-2-ylmethanol
PubChem CID43234424
Molecular FormulaC9H7ClOS2
Molecular Weight230.74 g/mol
Exact Mass229.96
IUPAC Name(5-chlorothiophen-2-yl)-thiophen-2-ylmethanol
SMILESOC(c1cccs1)c1ccc(Cl)s1
InChIInChI=1S/C9H7ClOS2/c10-8-4-3-7(13-8)9(11)6-2-1-5-12-6/h1-5,9,11H
InChIKeyKYPSMXWOSDXZDK-UHFFFAOYSA-N
XLogP3.54
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.74
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(R)-(5-chlorothiophen-2-yl)-thiophen-2-ylmethanol
CID 93029791
[5-[hydroxy(thiophen-2-yl)methyl]thiophen-2-yl]-thiophen-2-ylmethanol
CID 11197598
2-chloro-5-propan-2-ylthiophene;2-propan-2-ylthiophene
CID 165073785
2-chloro-5-[chloro(thiophen-2-yl)methyl]thiophene
CID 61084392
5-chloro-N-[[5-[hydroxy(thiophen-2-yl)methyl]thiophen-2-yl]methyl]thiophene-2-carboxamide
CID 71804635
1-(5-chlorothiophen-2-yl)-4-thiophen-2-ylbutan-1-ol
CID 105119774
(5-chlorothiophen-2-yl)-(5-chlorothiophen-3-yl)methanol
CID 130608755
4-[[(5-chlorothiophen-2-yl)-thiophen-2-ylmethyl]amino]phenol
CID 43790408
N-[(5-chlorothiophen-2-yl)-thiophen-2-ylmethyl]ethanamine
CID 43491982
N-[(5-chlorothiophen-2-yl)-thiophen-2-ylmethyl]pyrrol-1-amine
CID 79091085
(5-chlorothiophen-2-yl)-pyridin-2-ylmethanol
CID 79021425
2-[[(5-chlorothiophen-2-yl)-thiophen-2-ylmethyl]amino]-3-methylbutan-1-ol
CID 79254049

Frequently Asked Questions

What is the IUPAC name of (5-chlorothiophen-2-yl)-thiophen-2-ylmethanol?
The IUPAC name of (5-chlorothiophen-2-yl)-thiophen-2-ylmethanol (CID 43234424) is (5-chlorothiophen-2-yl)-thiophen-2-ylmethanol.
What is the SMILES notation for (5-chlorothiophen-2-yl)-thiophen-2-ylmethanol?
The canonical SMILES for (5-chlorothiophen-2-yl)-thiophen-2-ylmethanol is OC(c1cccs1)c1ccc(Cl)s1.
What is the InChIKey of (5-chlorothiophen-2-yl)-thiophen-2-ylmethanol?
The InChIKey is KYPSMXWOSDXZDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7ClOS2/c10-8-4-3-7(13-8)9(11)6-2-1-5-12-6/h1-5,9,11H.
What are the key properties of (5-chlorothiophen-2-yl)-thiophen-2-ylmethanol?
(5-chlorothiophen-2-yl)-thiophen-2-ylmethanol has a molecular weight of 230.74 g/mol, XLogP of 3.54, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5-chlorothiophen-2-yl)-thiophen-2-ylmethanol is sourced from PubChem (CID 43234424), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).