(5-chloro-2-fluorophenyl)-(4-chlorophenyl)methanol

C13H9Cl2FO — CID 61100029

IUPAC(5-chloro-2-fluorophenyl)-(4-chlorophenyl)methanol
SMILESOC(c1ccc(Cl)cc1)c1cc(Cl)ccc1F
InChIInChI=1S/C13H9Cl2FO/c14-9-3-1-8(2-4-9)13(17)11-7-10(15)5-6-12(11)16/h1-7,13,17H
InChIKeyFYEVVYIDWPVWKK-UHFFFAOYSA-N
MW271.12 g/mol
LogP4.21
Rot. Bonds2

About (5-chloro-2-fluorophenyl)-(4-chlorophenyl)methanol

(5-chloro-2-fluorophenyl)-(4-chlorophenyl)methanol (PubChem CID 61100029) has the molecular formula C13H9Cl2FO and a molecular weight of 271.12 g/mol. Its IUPAC name is (5-chloro-2-fluorophenyl)-(4-chlorophenyl)methanol.

Molecular Properties

Compound Name(5-chloro-2-fluorophenyl)-(4-chlorophenyl)methanol
PubChem CID61100029
Molecular FormulaC13H9Cl2FO
Molecular Weight271.12 g/mol
Exact Mass270.00
IUPAC Name(5-chloro-2-fluorophenyl)-(4-chlorophenyl)methanol
SMILESOC(c1ccc(Cl)cc1)c1cc(Cl)ccc1F
InChIInChI=1S/C13H9Cl2FO/c14-9-3-1-8(2-4-9)13(17)11-7-10(15)5-6-12(11)16/h1-7,13,17H
InChIKeyFYEVVYIDWPVWKK-UHFFFAOYSA-N
XLogP4.21
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.12
LogP ≤ 54.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(5-chloro-2-fluorophenyl)-(4-fluoro-3-methylphenyl)methanol
CID 79747556
(5-chloro-2-fluorophenyl)-naphthalen-2-ylmethanol
CID 114853062
(5-chloro-2-fluorophenyl)-(4-methoxy-3-methylphenyl)methanol
CID 61081454
(5-chloro-2-fluorophenyl)-[4-(2-methoxyethyl)phenyl]methanol
CID 61099907
(2,4-dichlorophenyl)-(4-fluorophenyl)methanol
CID 20506318
(4-chloro-2-fluorophenyl)-(4-iodophenyl)methanol
CID 115827844
(4-bromophenyl)-(4-chloro-2-fluorophenyl)methanol
CID 61101398
(4-chlorophenyl)-(5-fluoro-2-methylphenyl)methanol
CID 55133948
(5-chloro-2-fluorophenyl)-(2,3-dihydro-1-benzofuran-5-yl)methanol
CID 61100761
(4-chloro-3-fluorophenyl)-(5-chloro-2-methoxyphenyl)methanol
CID 63895530
[4-chloro-2-(hydroxymethyl)phenyl]-(4-fluorophenyl)methanol
CID 141261609
(5-chloro-2-methoxyphenyl)-[4-(difluoromethyl)phenyl]methanol
CID 115525000

Frequently Asked Questions

What is the IUPAC name of (5-chloro-2-fluorophenyl)-(4-chlorophenyl)methanol?
The IUPAC name of (5-chloro-2-fluorophenyl)-(4-chlorophenyl)methanol (CID 61100029) is (5-chloro-2-fluorophenyl)-(4-chlorophenyl)methanol.
What is the SMILES notation for (5-chloro-2-fluorophenyl)-(4-chlorophenyl)methanol?
The canonical SMILES for (5-chloro-2-fluorophenyl)-(4-chlorophenyl)methanol is OC(c1ccc(Cl)cc1)c1cc(Cl)ccc1F.
What is the InChIKey of (5-chloro-2-fluorophenyl)-(4-chlorophenyl)methanol?
The InChIKey is FYEVVYIDWPVWKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9Cl2FO/c14-9-3-1-8(2-4-9)13(17)11-7-10(15)5-6-12(11)16/h1-7,13,17H.
What are the key properties of (5-chloro-2-fluorophenyl)-(4-chlorophenyl)methanol?
(5-chloro-2-fluorophenyl)-(4-chlorophenyl)methanol has a molecular weight of 271.12 g/mol, XLogP of 4.21, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (5-chloro-2-fluorophenyl)-(4-chlorophenyl)methanol is sourced from PubChem (CID 61100029), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).