(5-bromothiophen-2-yl)-(2-methylthiophen-3-yl)methanol

C10H9BrOS2 — CID 102829132

IUPAC(5-bromothiophen-2-yl)-(2-methylthiophen-3-yl)methanol
SMILESCc1sccc1C(O)c1ccc(Br)s1
InChIInChI=1S/C10H9BrOS2/c1-6-7(4-5-13-6)10(12)8-2-3-9(11)14-8/h2-5,10,12H,1H3
InChIKeyCAQYCICIWKSMCD-UHFFFAOYSA-N
MW289.22 g/mol
LogP3.96
Rot. Bonds2

About (5-bromothiophen-2-yl)-(2-methylthiophen-3-yl)methanol

(5-bromothiophen-2-yl)-(2-methylthiophen-3-yl)methanol (PubChem CID 102829132) has the molecular formula C10H9BrOS2 and a molecular weight of 289.22 g/mol. Its IUPAC name is (5-bromothiophen-2-yl)-(2-methylthiophen-3-yl)methanol.

Molecular Properties

Compound Name(5-bromothiophen-2-yl)-(2-methylthiophen-3-yl)methanol
PubChem CID102829132
Molecular FormulaC10H9BrOS2
Molecular Weight289.22 g/mol
Exact Mass287.93
IUPAC Name(5-bromothiophen-2-yl)-(2-methylthiophen-3-yl)methanol
SMILESCc1sccc1C(O)c1ccc(Br)s1
InChIInChI=1S/C10H9BrOS2/c1-6-7(4-5-13-6)10(12)8-2-3-9(11)14-8/h2-5,10,12H,1H3
InChIKeyCAQYCICIWKSMCD-UHFFFAOYSA-N
XLogP3.96
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.22
LogP ≤ 53.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 79808941
(5-bromothiophen-2-yl)-(2,3-difluoro-4-methylphenyl)methanol
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(5-bromothiophen-2-yl)-(2-chloro-4,5-dimethylphenyl)methanol
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(5-bromothiophen-2-yl)-(2-iodophenyl)methanol
CID 61081917
(5-bromothiophen-2-yl)-(2,4,5-trimethoxyphenyl)methanol
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(5-bromothiophen-2-yl)-(2-chloro-4-fluoro-5-methylphenyl)methanol
CID 81045617
(5-bromothiophen-2-yl)-(2,4,5-trimethylfuran-3-yl)methanol
CID 65153269
(4-bromo-2,5-dimethoxyphenyl)-(5-bromothiophen-2-yl)methanol
CID 105056992
(5-bromothiophen-2-yl)-(3-methylfuran-2-yl)methanol
CID 61081936
(2-bromo-5-fluorophenyl)-(5-bromothiophen-2-yl)methanol
CID 61081150
(2-methylthiophen-3-yl)-thiophen-3-ylmethanol
CID 102829147
(5-bromothiophen-2-yl)-(3-fluoro-5-methylphenyl)methanol
CID 79691471

Frequently Asked Questions

What is the IUPAC name of (5-bromothiophen-2-yl)-(2-methylthiophen-3-yl)methanol?
The IUPAC name of (5-bromothiophen-2-yl)-(2-methylthiophen-3-yl)methanol (CID 102829132) is (5-bromothiophen-2-yl)-(2-methylthiophen-3-yl)methanol.
What is the SMILES notation for (5-bromothiophen-2-yl)-(2-methylthiophen-3-yl)methanol?
The canonical SMILES for (5-bromothiophen-2-yl)-(2-methylthiophen-3-yl)methanol is Cc1sccc1C(O)c1ccc(Br)s1.
What is the InChIKey of (5-bromothiophen-2-yl)-(2-methylthiophen-3-yl)methanol?
The InChIKey is CAQYCICIWKSMCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9BrOS2/c1-6-7(4-5-13-6)10(12)8-2-3-9(11)14-8/h2-5,10,12H,1H3.
What are the key properties of (5-bromothiophen-2-yl)-(2-methylthiophen-3-yl)methanol?
(5-bromothiophen-2-yl)-(2-methylthiophen-3-yl)methanol has a molecular weight of 289.22 g/mol, XLogP of 3.96, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5-bromothiophen-2-yl)-(2-methylthiophen-3-yl)methanol is sourced from PubChem (CID 102829132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).