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

C16H14ClFO — CID 105393945

IUPAC(2-chloro-5-fluorophenyl)-(4-cyclopropylphenyl)methanol
SMILESOC(c1ccc(C2CC2)cc1)c1cc(F)ccc1Cl
InChIInChI=1S/C16H14ClFO/c17-15-8-7-13(18)9-14(15)16(19)12-5-3-11(4-6-12)10-1-2-10/h3-10,16,19H,1-2H2
InChIKeySBAXUTRVZWLCOE-UHFFFAOYSA-N
MW276.74 g/mol
LogP4.44
Rot. Bonds3

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

(2-chloro-5-fluorophenyl)-(4-cyclopropylphenyl)methanol (PubChem CID 105393945) has the molecular formula C16H14ClFO and a molecular weight of 276.74 g/mol. Its IUPAC name is (2-chloro-5-fluorophenyl)-(4-cyclopropylphenyl)methanol.

Molecular Properties

Compound Name(2-chloro-5-fluorophenyl)-(4-cyclopropylphenyl)methanol
PubChem CID105393945
Molecular FormulaC16H14ClFO
Molecular Weight276.74 g/mol
Exact Mass276.07
IUPAC Name(2-chloro-5-fluorophenyl)-(4-cyclopropylphenyl)methanol
SMILESOC(c1ccc(C2CC2)cc1)c1cc(F)ccc1Cl
InChIInChI=1S/C16H14ClFO/c17-15-8-7-13(18)9-14(15)16(19)12-5-3-11(4-6-12)10-1-2-10/h3-10,16,19H,1-2H2
InChIKeySBAXUTRVZWLCOE-UHFFFAOYSA-N
XLogP4.44
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.74
LogP ≤ 54.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(2-bromo-5-fluorophenyl)-(4-cyclobutylphenyl)methanol
CID 115836289
(5-bromo-2-chlorophenyl)-(4-fluorophenyl)methanol
CID 61100202
(3-chloro-2-fluorophenyl)-(4-cyclobutylphenyl)methanol
CID 116505775
(2-chloro-5-fluorophenyl)-[4-(trifluoromethoxy)phenyl]methanol
CID 105393834
(3-chloro-5-fluorophenyl)-(4-cyclobutylphenyl)methanol
CID 114454040
(2-chloro-5-fluorophenyl)-(3-fluoro-5-methylphenyl)methanol
CID 105394565
2-(4-chloro-3-fluorophenyl)-1-(4-cyclopropylphenyl)ethanol
CID 107883644
(3-bromo-4-methylphenyl)-(2-chloro-5-fluorophenyl)methanol
CID 105397627
(4-chloro-3-methylphenyl)-(4-cyclobutylphenyl)methanol
CID 115836307
(2-chloro-5-fluorophenyl)methanediol
CID 71441110
(3-bromophenyl)-(2-chloro-5-fluorophenyl)methanol
CID 105393805
(4-cyclopropylphenyl)-(3-fluoro-4-methylphenyl)methanol
CID 107128111

Frequently Asked Questions

What is the IUPAC name of (2-chloro-5-fluorophenyl)-(4-cyclopropylphenyl)methanol?
The IUPAC name of (2-chloro-5-fluorophenyl)-(4-cyclopropylphenyl)methanol (CID 105393945) is (2-chloro-5-fluorophenyl)-(4-cyclopropylphenyl)methanol.
What is the SMILES notation for (2-chloro-5-fluorophenyl)-(4-cyclopropylphenyl)methanol?
The canonical SMILES for (2-chloro-5-fluorophenyl)-(4-cyclopropylphenyl)methanol is OC(c1ccc(C2CC2)cc1)c1cc(F)ccc1Cl.
What is the InChIKey of (2-chloro-5-fluorophenyl)-(4-cyclopropylphenyl)methanol?
The InChIKey is SBAXUTRVZWLCOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14ClFO/c17-15-8-7-13(18)9-14(15)16(19)12-5-3-11(4-6-12)10-1-2-10/h3-10,16,19H,1-2H2.
What are the key properties of (2-chloro-5-fluorophenyl)-(4-cyclopropylphenyl)methanol?
(2-chloro-5-fluorophenyl)-(4-cyclopropylphenyl)methanol has a molecular weight of 276.74 g/mol, XLogP of 4.44, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2-chloro-5-fluorophenyl)-(4-cyclopropylphenyl)methanol is sourced from PubChem (CID 105393945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).