(4-butan-2-ylphenyl)-(3,4-dimethylphenyl)methanol

C19H24O — CID 63426275

IUPAC(4-butan-2-ylphenyl)-(3,4-dimethylphenyl)methanol
SMILESCCC(C)c1ccc(C(O)c2ccc(C)c(C)c2)cc1
InChIInChI=1S/C19H24O/c1-5-13(2)16-8-10-17(11-9-16)19(20)18-7-6-14(3)15(4)12-18/h6-13,19-20H,5H2,1-4H3
InChIKeyDHPVJDPOARGLBI-UHFFFAOYSA-N
MW268.40 g/mol
LogP4.90
Rot. Bonds4

About (4-butan-2-ylphenyl)-(3,4-dimethylphenyl)methanol

(4-butan-2-ylphenyl)-(3,4-dimethylphenyl)methanol (PubChem CID 63426275) has the molecular formula C19H24O and a molecular weight of 268.40 g/mol. Its IUPAC name is (4-butan-2-ylphenyl)-(3,4-dimethylphenyl)methanol.

Molecular Properties

Compound Name(4-butan-2-ylphenyl)-(3,4-dimethylphenyl)methanol
PubChem CID63426275
Molecular FormulaC19H24O
Molecular Weight268.40 g/mol
Exact Mass268.18
IUPAC Name(4-butan-2-ylphenyl)-(3,4-dimethylphenyl)methanol
SMILESCCC(C)c1ccc(C(O)c2ccc(C)c(C)c2)cc1
InChIInChI=1S/C19H24O/c1-5-13(2)16-8-10-17(11-9-16)19(20)18-7-6-14(3)15(4)12-18/h6-13,19-20H,5H2,1-4H3
InChIKeyDHPVJDPOARGLBI-UHFFFAOYSA-N
XLogP4.90
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 54.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(4-butan-2-ylphenyl)-(4-fluoro-3-methylphenyl)methanol
CID 63426051
(4-butan-2-ylphenyl)-(3,4-dimethylphenyl)methanamine
CID 43108648
(3,4-dimethylphenyl)-(4-propan-2-yloxyphenyl)methanol
CID 61086884
(4-butan-2-ylphenyl)-(4,5-dimethylthiophen-2-yl)methanol
CID 65238991
(3-bromo-4-chlorophenyl)-(4-butan-2-ylphenyl)methanol
CID 107991127
(4-butan-2-ylphenyl)-(3-chloro-4-fluorophenyl)methanol
CID 82879198
(4-butan-2-ylphenyl)-(3-chloro-5-methylphenyl)methanol
CID 81324135
(R)-(3,4-dimethylphenyl)-(4-phenylphenyl)methanol
CID 100803935
(R)-(4-amino-3-methylphenyl)-(3,4-dimethylphenyl)methanol
CID 100804122
(R)-(3-amino-4-methylphenyl)-(3,4-dimethylphenyl)methanol
CID 100804028
(4-bromo-2-methoxyphenyl)-(4-butan-2-ylphenyl)methanol
CID 115369721
1,2-dimethyl-4-(3-methylpentan-2-yl)benzene
CID 54500357

Frequently Asked Questions

What is the IUPAC name of (4-butan-2-ylphenyl)-(3,4-dimethylphenyl)methanol?
The IUPAC name of (4-butan-2-ylphenyl)-(3,4-dimethylphenyl)methanol (CID 63426275) is (4-butan-2-ylphenyl)-(3,4-dimethylphenyl)methanol.
What is the SMILES notation for (4-butan-2-ylphenyl)-(3,4-dimethylphenyl)methanol?
The canonical SMILES for (4-butan-2-ylphenyl)-(3,4-dimethylphenyl)methanol is CCC(C)c1ccc(C(O)c2ccc(C)c(C)c2)cc1.
What is the InChIKey of (4-butan-2-ylphenyl)-(3,4-dimethylphenyl)methanol?
The InChIKey is DHPVJDPOARGLBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24O/c1-5-13(2)16-8-10-17(11-9-16)19(20)18-7-6-14(3)15(4)12-18/h6-13,19-20H,5H2,1-4H3.
What are the key properties of (4-butan-2-ylphenyl)-(3,4-dimethylphenyl)methanol?
(4-butan-2-ylphenyl)-(3,4-dimethylphenyl)methanol has a molecular weight of 268.40 g/mol, XLogP of 4.90, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4-butan-2-ylphenyl)-(3,4-dimethylphenyl)methanol is sourced from PubChem (CID 63426275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).