(3,4-dimethylphenyl)-(4-propan-2-yloxyphenyl)methanol

C18H22O2 — CID 61086884

IUPAC(3,4-dimethylphenyl)-(4-propan-2-yloxyphenyl)methanol
SMILESCc1ccc(C(O)c2ccc(OC(C)C)cc2)cc1C
InChIInChI=1S/C18H22O2/c1-12(2)20-17-9-7-15(8-10-17)18(19)16-6-5-13(3)14(4)11-16/h5-12,18-19H,1-4H3
InChIKeyAZHZDPIFANEMBK-UHFFFAOYSA-N
MW270.37 g/mol
LogP4.17
Rot. Bonds4

About (3,4-dimethylphenyl)-(4-propan-2-yloxyphenyl)methanol

(3,4-dimethylphenyl)-(4-propan-2-yloxyphenyl)methanol (PubChem CID 61086884) has the molecular formula C18H22O2 and a molecular weight of 270.37 g/mol. Its IUPAC name is (3,4-dimethylphenyl)-(4-propan-2-yloxyphenyl)methanol.

Molecular Properties

Compound Name(3,4-dimethylphenyl)-(4-propan-2-yloxyphenyl)methanol
PubChem CID61086884
Molecular FormulaC18H22O2
Molecular Weight270.37 g/mol
Exact Mass270.16
IUPAC Name(3,4-dimethylphenyl)-(4-propan-2-yloxyphenyl)methanol
SMILESCc1ccc(C(O)c2ccc(OC(C)C)cc2)cc1C
InChIInChI=1S/C18H22O2/c1-12(2)20-17-9-7-15(8-10-17)18(19)16-6-5-13(3)14(4)11-16/h5-12,18-19H,1-4H3
InChIKeyAZHZDPIFANEMBK-UHFFFAOYSA-N
XLogP4.17
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.37
LogP ≤ 54.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(4-butan-2-ylphenyl)-(3,4-dimethylphenyl)methanol
CID 63426275
(2-methoxy-4-methylphenyl)-(4-propan-2-yloxyphenyl)methanol
CID 106790887
(R)-(3,4-dimethylphenyl)-(4-phenylphenyl)methanol
CID 100803935
(4-propan-2-yloxyphenyl)-(4-propylphenyl)methanol
CID 63890920
(R)-(4-amino-3-methylphenyl)-(3,4-dimethylphenyl)methanol
CID 100804122
(R)-(3-amino-4-methylphenyl)-(3,4-dimethylphenyl)methanol
CID 100804028
(3-bromo-5-chlorophenyl)-(4-propan-2-yloxyphenyl)methanol
CID 107947461
(4-aminophenyl)-(3-propan-2-yloxyphenyl)methanol
CID 106695525
(3-fluoro-4-methylphenyl)-(4-methoxyphenyl)methanol
CID 60798694
methane;2-methoxy-1-methyl-4-propan-2-yloxybenzene;1-methyl-4-propan-2-yloxybenzene
CID 159264370
4-[bromo-(4-propan-2-yloxyphenyl)methyl]-1-fluoro-2-methylbenzene
CID 63441611
(3,4-dimethylphenyl)-(5-methylthiophen-3-yl)methanol
CID 65100079

Frequently Asked Questions

What is the IUPAC name of (3,4-dimethylphenyl)-(4-propan-2-yloxyphenyl)methanol?
The IUPAC name of (3,4-dimethylphenyl)-(4-propan-2-yloxyphenyl)methanol (CID 61086884) is (3,4-dimethylphenyl)-(4-propan-2-yloxyphenyl)methanol.
What is the SMILES notation for (3,4-dimethylphenyl)-(4-propan-2-yloxyphenyl)methanol?
The canonical SMILES for (3,4-dimethylphenyl)-(4-propan-2-yloxyphenyl)methanol is Cc1ccc(C(O)c2ccc(OC(C)C)cc2)cc1C.
What is the InChIKey of (3,4-dimethylphenyl)-(4-propan-2-yloxyphenyl)methanol?
The InChIKey is AZHZDPIFANEMBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22O2/c1-12(2)20-17-9-7-15(8-10-17)18(19)16-6-5-13(3)14(4)11-16/h5-12,18-19H,1-4H3.
What are the key properties of (3,4-dimethylphenyl)-(4-propan-2-yloxyphenyl)methanol?
(3,4-dimethylphenyl)-(4-propan-2-yloxyphenyl)methanol has a molecular weight of 270.37 g/mol, XLogP of 4.17, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3,4-dimethylphenyl)-(4-propan-2-yloxyphenyl)methanol is sourced from PubChem (CID 61086884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).