(5-chloro-2-fluorophenyl)-(4-fluoro-3-methylphenyl)methanol

C14H11ClF2O — CID 79747556

IUPAC(5-chloro-2-fluorophenyl)-(4-fluoro-3-methylphenyl)methanol
SMILESCc1cc(C(O)c2cc(Cl)ccc2F)ccc1F
InChIInChI=1S/C14H11ClF2O/c1-8-6-9(2-4-12(8)16)14(18)11-7-10(15)3-5-13(11)17/h2-7,14,18H,1H3
InChIKeyBHKPMGCBDRDSRE-UHFFFAOYSA-N
MW268.69 g/mol
LogP4.01
Rot. Bonds2

About (5-chloro-2-fluorophenyl)-(4-fluoro-3-methylphenyl)methanol

(5-chloro-2-fluorophenyl)-(4-fluoro-3-methylphenyl)methanol (PubChem CID 79747556) has the molecular formula C14H11ClF2O and a molecular weight of 268.69 g/mol. Its IUPAC name is (5-chloro-2-fluorophenyl)-(4-fluoro-3-methylphenyl)methanol.

Molecular Properties

Compound Name(5-chloro-2-fluorophenyl)-(4-fluoro-3-methylphenyl)methanol
PubChem CID79747556
Molecular FormulaC14H11ClF2O
Molecular Weight268.69 g/mol
Exact Mass268.05
IUPAC Name(5-chloro-2-fluorophenyl)-(4-fluoro-3-methylphenyl)methanol
SMILESCc1cc(C(O)c2cc(Cl)ccc2F)ccc1F
InChIInChI=1S/C14H11ClF2O/c1-8-6-9(2-4-12(8)16)14(18)11-7-10(15)3-5-13(11)17/h2-7,14,18H,1H3
InChIKeyBHKPMGCBDRDSRE-UHFFFAOYSA-N
XLogP4.01
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.69
LogP ≤ 54.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(2,5-difluorophenyl)-(4-fluoro-3-methylphenyl)methanol
CID 62802735
(5-chloro-2-fluorophenyl)-(4-methoxy-3-methylphenyl)methanol
CID 61081454
(5-chloro-2-fluorophenyl)-(4-chlorophenyl)methanol
CID 61100029
(2-chloro-4,5-dimethylphenyl)-(4-fluoro-3-methylphenyl)methanol
CID 115484419
(4-bromo-5-chloro-2-fluorophenyl)-(4-fluoro-3-methylphenyl)methanol
CID 105399490
(2-chloro-4-fluorophenyl)-(4-fluoro-3-methylphenyl)methanol
CID 55152989
(3,5-dichlorophenyl)-(4-fluoro-3-methylphenyl)methanol
CID 63899311
(5-chloro-2-fluorophenyl)-(4-fluoro-3-methylphenyl)methanamine
CID 79746385
(5-chloro-2-fluorophenyl)-naphthalen-2-ylmethanol
CID 114853062
(3-bromo-4-fluorophenyl)-(2,5-difluoro-4-methylphenyl)methanol
CID 107955698
(5-bromo-2-fluorophenyl)-(4-bromo-3-methylphenyl)methanol
CID 81447497
(4-fluoro-3-methylphenyl)methanediol
CID 45090626

Frequently Asked Questions

What is the IUPAC name of (5-chloro-2-fluorophenyl)-(4-fluoro-3-methylphenyl)methanol?
The IUPAC name of (5-chloro-2-fluorophenyl)-(4-fluoro-3-methylphenyl)methanol (CID 79747556) is (5-chloro-2-fluorophenyl)-(4-fluoro-3-methylphenyl)methanol.
What is the SMILES notation for (5-chloro-2-fluorophenyl)-(4-fluoro-3-methylphenyl)methanol?
The canonical SMILES for (5-chloro-2-fluorophenyl)-(4-fluoro-3-methylphenyl)methanol is Cc1cc(C(O)c2cc(Cl)ccc2F)ccc1F.
What is the InChIKey of (5-chloro-2-fluorophenyl)-(4-fluoro-3-methylphenyl)methanol?
The InChIKey is BHKPMGCBDRDSRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11ClF2O/c1-8-6-9(2-4-12(8)16)14(18)11-7-10(15)3-5-13(11)17/h2-7,14,18H,1H3.
What are the key properties of (5-chloro-2-fluorophenyl)-(4-fluoro-3-methylphenyl)methanol?
(5-chloro-2-fluorophenyl)-(4-fluoro-3-methylphenyl)methanol has a molecular weight of 268.69 g/mol, XLogP of 4.01, 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-fluoro-3-methylphenyl)methanol is sourced from PubChem (CID 79747556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).