(5-chloro-2-methylphenyl)-(2,3-difluorophenyl)methanol

C14H11ClF2O — CID 115800933

IUPAC(5-chloro-2-methylphenyl)-(2,3-difluorophenyl)methanol
SMILESCc1ccc(Cl)cc1C(O)c1cccc(F)c1F
InChIInChI=1S/C14H11ClF2O/c1-8-5-6-9(15)7-11(8)14(18)10-3-2-4-12(16)13(10)17/h2-7,14,18H,1H3
InChIKeyZWRXCAUZOPTIOC-UHFFFAOYSA-N
MW268.69 g/mol
LogP4.01
Rot. Bonds2

About (5-chloro-2-methylphenyl)-(2,3-difluorophenyl)methanol

(5-chloro-2-methylphenyl)-(2,3-difluorophenyl)methanol (PubChem CID 115800933) has the molecular formula C14H11ClF2O and a molecular weight of 268.69 g/mol. Its IUPAC name is (5-chloro-2-methylphenyl)-(2,3-difluorophenyl)methanol.

Molecular Properties

Compound Name(5-chloro-2-methylphenyl)-(2,3-difluorophenyl)methanol
PubChem CID115800933
Molecular FormulaC14H11ClF2O
Molecular Weight268.69 g/mol
Exact Mass268.05
IUPAC Name(5-chloro-2-methylphenyl)-(2,3-difluorophenyl)methanol
SMILESCc1ccc(Cl)cc1C(O)c1cccc(F)c1F
InChIInChI=1S/C14H11ClF2O/c1-8-5-6-9(15)7-11(8)14(18)10-3-2-4-12(16)13(10)17/h2-7,14,18H,1H3
InChIKeyZWRXCAUZOPTIOC-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-chloro-4,5-dimethylphenyl)-(2,3-difluorophenyl)methanol
CID 115484592
(2,3-difluorophenyl)-(2-fluoro-5-methylphenyl)methanol
CID 63894755
(2-chloro-3-fluorophenyl)-(2,3-difluoro-4-methylphenyl)methanol
CID 107516247
(5-chloro-2-methylphenyl)-(7-fluoro-1-benzofuran-2-yl)methanol
CID 115837002
(5-fluoro-2-methylphenyl)-(2,3,4-trifluorophenyl)methanol
CID 62964628
(5-chloro-2-methylphenyl)-(2,4,6-trifluorophenyl)methanol
CID 82883112
(2,5-dibromo-4-methylphenyl)-(2,3-difluorophenyl)methanol
CID 81473865
(2-chloro-3-fluorophenyl)-(2,4,5-trimethylphenyl)methanol
CID 115807096
(4-chlorophenyl)-(2-fluoro-3-methylphenyl)methanol
CID 81477274
(3-chloro-2-fluorophenyl)-(2,4-dichlorophenyl)methanol
CID 81266328
(S)-(3-bromophenyl)-(5-chloro-2-methylphenyl)methanol
CID 97293534
2-(2-chloro-3-fluorophenyl)-1-(5-chloro-2-methylphenyl)ethanol
CID 115831225

Frequently Asked Questions

What is the IUPAC name of (5-chloro-2-methylphenyl)-(2,3-difluorophenyl)methanol?
The IUPAC name of (5-chloro-2-methylphenyl)-(2,3-difluorophenyl)methanol (CID 115800933) is (5-chloro-2-methylphenyl)-(2,3-difluorophenyl)methanol.
What is the SMILES notation for (5-chloro-2-methylphenyl)-(2,3-difluorophenyl)methanol?
The canonical SMILES for (5-chloro-2-methylphenyl)-(2,3-difluorophenyl)methanol is Cc1ccc(Cl)cc1C(O)c1cccc(F)c1F.
What is the InChIKey of (5-chloro-2-methylphenyl)-(2,3-difluorophenyl)methanol?
The InChIKey is ZWRXCAUZOPTIOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11ClF2O/c1-8-5-6-9(15)7-11(8)14(18)10-3-2-4-12(16)13(10)17/h2-7,14,18H,1H3.
What are the key properties of (5-chloro-2-methylphenyl)-(2,3-difluorophenyl)methanol?
(5-chloro-2-methylphenyl)-(2,3-difluorophenyl)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-methylphenyl)-(2,3-difluorophenyl)methanol is sourced from PubChem (CID 115800933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).