(3-bromothiophen-2-yl)-(5-chloro-2-fluorophenyl)methanol

C11H7BrClFOS — CID 80535916

IUPAC(3-bromothiophen-2-yl)-(5-chloro-2-fluorophenyl)methanol
SMILESOC(c1cc(Cl)ccc1F)c1sccc1Br
InChIInChI=1S/C11H7BrClFOS/c12-8-3-4-16-11(8)10(15)7-5-6(13)1-2-9(7)14/h1-5,10,15H
InChIKeyHBLWBXJFCOYYTM-UHFFFAOYSA-N
MW321.60 g/mol
LogP4.38
Rot. Bonds2

About (3-bromothiophen-2-yl)-(5-chloro-2-fluorophenyl)methanol

(3-bromothiophen-2-yl)-(5-chloro-2-fluorophenyl)methanol (PubChem CID 80535916) has the molecular formula C11H7BrClFOS and a molecular weight of 321.60 g/mol. Its IUPAC name is (3-bromothiophen-2-yl)-(5-chloro-2-fluorophenyl)methanol.

Molecular Properties

Compound Name(3-bromothiophen-2-yl)-(5-chloro-2-fluorophenyl)methanol
PubChem CID80535916
Molecular FormulaC11H7BrClFOS
Molecular Weight321.60 g/mol
Exact Mass319.91
IUPAC Name(3-bromothiophen-2-yl)-(5-chloro-2-fluorophenyl)methanol
SMILESOC(c1cc(Cl)ccc1F)c1sccc1Br
InChIInChI=1S/C11H7BrClFOS/c12-8-3-4-16-11(8)10(15)7-5-6(13)1-2-9(7)14/h1-5,10,15H
InChIKeyHBLWBXJFCOYYTM-UHFFFAOYSA-N
XLogP4.38
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.60
LogP ≤ 54.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(5-chloro-2-fluorophenyl)-(3-chlorothiophen-2-yl)methanol
CID 80529355
(3-bromothiophen-2-yl)-(2,4-difluoro-5-methylphenyl)methanol
CID 79730854
(2-bromo-5-chlorophenyl)-(3-chlorothiophen-2-yl)methanol
CID 107359087
(2-bromo-4-fluorophenyl)-(3-bromothiophen-2-yl)methanol
CID 80535969
N-[(3-bromothiophen-2-yl)-(5-chloro-2-fluorophenyl)methyl]ethanamine
CID 80535170
(3-bromo-2-fluorophenyl)-(3-bromothiophen-2-yl)methanol
CID 106644525
(4-chloro-2-fluorophenyl)-(3-chlorothiophen-2-yl)methanol
CID 80530486
(3-chlorothiophen-2-yl)-(2,4-difluoro-5-methylphenyl)methanol
CID 80641878
1-(3-bromothiophen-2-yl)-2-(2,5-dichlorophenyl)ethanol
CID 113298218
(5-chloro-2-fluorophenyl)-(4-chlorophenyl)methanol
CID 61100029
(3-bromo-5-chloro-2-methoxyphenyl)-(3-chlorothiophen-2-yl)methanol
CID 80642254
[2-amino-5-(trifluoromethyl)phenyl]-(3-bromothiophen-2-yl)methanol
CID 112556351

Frequently Asked Questions

What is the IUPAC name of (3-bromothiophen-2-yl)-(5-chloro-2-fluorophenyl)methanol?
The IUPAC name of (3-bromothiophen-2-yl)-(5-chloro-2-fluorophenyl)methanol (CID 80535916) is (3-bromothiophen-2-yl)-(5-chloro-2-fluorophenyl)methanol.
What is the SMILES notation for (3-bromothiophen-2-yl)-(5-chloro-2-fluorophenyl)methanol?
The canonical SMILES for (3-bromothiophen-2-yl)-(5-chloro-2-fluorophenyl)methanol is OC(c1cc(Cl)ccc1F)c1sccc1Br.
What is the InChIKey of (3-bromothiophen-2-yl)-(5-chloro-2-fluorophenyl)methanol?
The InChIKey is HBLWBXJFCOYYTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7BrClFOS/c12-8-3-4-16-11(8)10(15)7-5-6(13)1-2-9(7)14/h1-5,10,15H.
What are the key properties of (3-bromothiophen-2-yl)-(5-chloro-2-fluorophenyl)methanol?
(3-bromothiophen-2-yl)-(5-chloro-2-fluorophenyl)methanol has a molecular weight of 321.60 g/mol, XLogP of 4.38, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3-bromothiophen-2-yl)-(5-chloro-2-fluorophenyl)methanol is sourced from PubChem (CID 80535916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).