(3,5-difluorophenyl)-(2,4,5-trimethylphenyl)methanol

C16H16F2O — CID 64990191

IUPAC(3,5-difluorophenyl)-(2,4,5-trimethylphenyl)methanol
SMILESCc1cc(C)c(C(O)c2cc(F)cc(F)c2)cc1C
InChIInChI=1S/C16H16F2O/c1-9-4-11(3)15(5-10(9)2)16(19)12-6-13(17)8-14(18)7-12/h4-8,16,19H,1-3H3
InChIKeySIQNNSSBGLJBFH-UHFFFAOYSA-N
MW262.30 g/mol
LogP3.97
Rot. Bonds2

About (3,5-difluorophenyl)-(2,4,5-trimethylphenyl)methanol

(3,5-difluorophenyl)-(2,4,5-trimethylphenyl)methanol (PubChem CID 64990191) has the molecular formula C16H16F2O and a molecular weight of 262.30 g/mol. Its IUPAC name is (3,5-difluorophenyl)-(2,4,5-trimethylphenyl)methanol.

Molecular Properties

Compound Name(3,5-difluorophenyl)-(2,4,5-trimethylphenyl)methanol
PubChem CID64990191
Molecular FormulaC16H16F2O
Molecular Weight262.30 g/mol
Exact Mass262.12
IUPAC Name(3,5-difluorophenyl)-(2,4,5-trimethylphenyl)methanol
SMILESCc1cc(C)c(C(O)c2cc(F)cc(F)c2)cc1C
InChIInChI=1S/C16H16F2O/c1-9-4-11(3)15(5-10(9)2)16(19)12-6-13(17)8-14(18)7-12/h4-8,16,19H,1-3H3
InChIKeySIQNNSSBGLJBFH-UHFFFAOYSA-N
XLogP3.97
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.30
LogP ≤ 53.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(3,5-difluorophenyl)-N-methyl-1-(2,4,5-trimethylphenyl)methanamine
CID 64990005
(3-bromo-5-fluorophenyl)-(2-chloro-4,5-dimethylphenyl)methanol
CID 115484421
(3,5-difluorophenyl)-(1,5-dimethylpyrazol-4-yl)methanol
CID 79584482
(5-fluoro-3-pyridinyl)-(4-methoxy-2,5-dimethylphenyl)methanol
CID 105124352
(2-fluoro-3-methylphenyl)-(3-fluoro-5-methylphenyl)methanol
CID 115823134
(3-methylphenyl)-(2,4,5-trimethylphenyl)methanol
CID 64985341
(3,5-difluorophenyl)-(2,5-dimethoxyphenyl)methanol
CID 61100568
(2-chloro-4,5-dimethylphenyl)-(3,4,5-trifluorophenyl)methanol
CID 115484480
(2-bromo-3-methylphenyl)-(3-fluoro-5-methylphenyl)methanol
CID 107985786
(1,5-dimethylpyrazol-4-yl)-(3-fluoro-5-methylphenyl)methanol
CID 79705223
(4-bromo-3,5-dimethylphenyl)-(5-fluoro-2-methylphenyl)methanol
CID 114329952
(5-bromo-2-fluorophenyl)-(2,4,5-trimethylphenyl)methanol
CID 64985386

Frequently Asked Questions

What is the IUPAC name of (3,5-difluorophenyl)-(2,4,5-trimethylphenyl)methanol?
The IUPAC name of (3,5-difluorophenyl)-(2,4,5-trimethylphenyl)methanol (CID 64990191) is (3,5-difluorophenyl)-(2,4,5-trimethylphenyl)methanol.
What is the SMILES notation for (3,5-difluorophenyl)-(2,4,5-trimethylphenyl)methanol?
The canonical SMILES for (3,5-difluorophenyl)-(2,4,5-trimethylphenyl)methanol is Cc1cc(C)c(C(O)c2cc(F)cc(F)c2)cc1C.
What is the InChIKey of (3,5-difluorophenyl)-(2,4,5-trimethylphenyl)methanol?
The InChIKey is SIQNNSSBGLJBFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16F2O/c1-9-4-11(3)15(5-10(9)2)16(19)12-6-13(17)8-14(18)7-12/h4-8,16,19H,1-3H3.
What are the key properties of (3,5-difluorophenyl)-(2,4,5-trimethylphenyl)methanol?
(3,5-difluorophenyl)-(2,4,5-trimethylphenyl)methanol has a molecular weight of 262.30 g/mol, XLogP of 3.97, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3,5-difluorophenyl)-(2,4,5-trimethylphenyl)methanol is sourced from PubChem (CID 64990191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).