(5-bromothiophen-3-yl)-thiophen-2-ylmethanol

C9H7BrOS2 — CID 105079878

IUPAC(5-bromothiophen-3-yl)-thiophen-2-ylmethanol
SMILESOC(c1csc(Br)c1)c1cccs1
InChIInChI=1S/C9H7BrOS2/c10-8-4-6(5-13-8)9(11)7-2-1-3-12-7/h1-5,9,11H
InChIKeyFZYJNAZLQQAKPF-UHFFFAOYSA-N
MW275.19 g/mol
LogP3.65
Rot. Bonds2

About (5-bromothiophen-3-yl)-thiophen-2-ylmethanol

(5-bromothiophen-3-yl)-thiophen-2-ylmethanol (PubChem CID 105079878) has the molecular formula C9H7BrOS2 and a molecular weight of 275.19 g/mol. Its IUPAC name is (5-bromothiophen-3-yl)-thiophen-2-ylmethanol.

Molecular Properties

Compound Name(5-bromothiophen-3-yl)-thiophen-2-ylmethanol
PubChem CID105079878
Molecular FormulaC9H7BrOS2
Molecular Weight275.19 g/mol
Exact Mass273.91
IUPAC Name(5-bromothiophen-3-yl)-thiophen-2-ylmethanol
SMILESOC(c1csc(Br)c1)c1cccs1
InChIInChI=1S/C9H7BrOS2/c10-8-4-6(5-13-8)9(11)7-2-1-3-12-7/h1-5,9,11H
InChIKeyFZYJNAZLQQAKPF-UHFFFAOYSA-N
XLogP3.65
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.19
LogP ≤ 53.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(5-bromo-4-methylthiophen-2-yl)-(5-bromothiophen-3-yl)methanol
CID 107964321
1-benzothiophen-7-yl-(5-bromothiophen-3-yl)methanol
CID 105119099
[3-(difluoromethyl)phenyl]-thiophen-2-ylmethanol
CID 115527711
(5-bromothiophen-3-yl)-(furan-3-yl)methanol
CID 105097126
[5-[hydroxy(thiophen-2-yl)methyl]thiophen-2-yl]-thiophen-2-ylmethanol
CID 11197598
1-benzofuran-2-yl-(5-bromothiophen-3-yl)methanol
CID 105128806
(S)-(3-chloro-4-fluorophenyl)-thiophen-2-ylmethanol
CID 95011849
(3,4-diethylphenyl)-thiophen-2-ylmethanol
CID 115482624
(R)-[4-(dimethylamino)phenyl]-thiophen-2-ylmethanol
CID 686964
(4-ethylphenyl)-thiophen-2-ylmethanol
CID 61104575
(5-bromothiophen-3-yl)-(2,4,6-trimethylphenyl)methanol
CID 114021555
(4-phenylthiophen-2-yl)-thiophen-2-ylmethanol
CID 16641209

Frequently Asked Questions

What is the IUPAC name of (5-bromothiophen-3-yl)-thiophen-2-ylmethanol?
The IUPAC name of (5-bromothiophen-3-yl)-thiophen-2-ylmethanol (CID 105079878) is (5-bromothiophen-3-yl)-thiophen-2-ylmethanol.
What is the SMILES notation for (5-bromothiophen-3-yl)-thiophen-2-ylmethanol?
The canonical SMILES for (5-bromothiophen-3-yl)-thiophen-2-ylmethanol is OC(c1csc(Br)c1)c1cccs1.
What is the InChIKey of (5-bromothiophen-3-yl)-thiophen-2-ylmethanol?
The InChIKey is FZYJNAZLQQAKPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7BrOS2/c10-8-4-6(5-13-8)9(11)7-2-1-3-12-7/h1-5,9,11H.
What are the key properties of (5-bromothiophen-3-yl)-thiophen-2-ylmethanol?
(5-bromothiophen-3-yl)-thiophen-2-ylmethanol has a molecular weight of 275.19 g/mol, XLogP of 3.65, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5-bromothiophen-3-yl)-thiophen-2-ylmethanol is sourced from PubChem (CID 105079878), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).