1-(3,5-dimethylphenyl)-1-(3-propylphenyl)ethanol

C19H24O — CID 116542790

IUPAC1-(3,5-dimethylphenyl)-1-(3-propylphenyl)ethanol
SMILESCCCc1cccc(C(C)(O)c2cc(C)cc(C)c2)c1
InChIInChI=1S/C19H24O/c1-5-7-16-8-6-9-17(13-16)19(4,20)18-11-14(2)10-15(3)12-18/h6,8-13,20H,5,7H2,1-4H3
InChIKeyXAVHQIBQLARIQJ-UHFFFAOYSA-N
MW268.40 g/mol
LogP4.51
Rot. Bonds4

About 1-(3,5-dimethylphenyl)-1-(3-propylphenyl)ethanol

1-(3,5-dimethylphenyl)-1-(3-propylphenyl)ethanol (PubChem CID 116542790) has the molecular formula C19H24O and a molecular weight of 268.40 g/mol. Its IUPAC name is 1-(3,5-dimethylphenyl)-1-(3-propylphenyl)ethanol.

Molecular Properties

Compound Name1-(3,5-dimethylphenyl)-1-(3-propylphenyl)ethanol
PubChem CID116542790
Molecular FormulaC19H24O
Molecular Weight268.40 g/mol
Exact Mass268.18
IUPAC Name1-(3,5-dimethylphenyl)-1-(3-propylphenyl)ethanol
SMILESCCCc1cccc(C(C)(O)c2cc(C)cc(C)c2)c1
InChIInChI=1S/C19H24O/c1-5-7-16-8-6-9-17(13-16)19(4,20)18-11-14(2)10-15(3)12-18/h6,8-13,20H,5,7H2,1-4H3
InChIKeyXAVHQIBQLARIQJ-UHFFFAOYSA-N
XLogP4.51
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 ≤ 54.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(4-fluorophenyl)-1-(3-propylphenyl)ethanol
CID 116542276
1-(3,5-dimethylphenyl)-1-[3-(2-methylpropyl)phenyl]ethanol
CID 116542789
3-[1-hydroxy-1-(3-propylphenyl)ethyl]benzonitrile
CID 116542774
1-(3-methylthiophen-2-yl)-1-(3-propylphenyl)ethanol
CID 116542561
3-(3-propylphenyl)pentan-3-ol
CID 116542305
1-(2-chlorophenyl)-1-(3-propylphenyl)ethanol
CID 116542288
1-methyl-4-[2-(3-propylphenyl)propan-2-yl]benzene
CID 123328001
1-tert-butyl-3-(2,2-dimethylpropyl)benzene;1-(2,2-dimethylpropyl)-3-propylbenzene
CID 145400173
1,1,1,3,3,3-hexafluoro-2-(3-propylphenyl)propan-2-ol
CID 20728974
1-(3-bromophenyl)-1-(4-propylphenyl)ethanol
CID 63406796
1-(2-methylsulfanylpropan-2-yl)-3-propylbenzene
CID 91471137
1,2-bis(3-methylphenyl)propan-2-ol
CID 60798209

Frequently Asked Questions

What is the IUPAC name of 1-(3,5-dimethylphenyl)-1-(3-propylphenyl)ethanol?
The IUPAC name of 1-(3,5-dimethylphenyl)-1-(3-propylphenyl)ethanol (CID 116542790) is 1-(3,5-dimethylphenyl)-1-(3-propylphenyl)ethanol.
What is the SMILES notation for 1-(3,5-dimethylphenyl)-1-(3-propylphenyl)ethanol?
The canonical SMILES for 1-(3,5-dimethylphenyl)-1-(3-propylphenyl)ethanol is CCCc1cccc(C(C)(O)c2cc(C)cc(C)c2)c1.
What is the InChIKey of 1-(3,5-dimethylphenyl)-1-(3-propylphenyl)ethanol?
The InChIKey is XAVHQIBQLARIQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24O/c1-5-7-16-8-6-9-17(13-16)19(4,20)18-11-14(2)10-15(3)12-18/h6,8-13,20H,5,7H2,1-4H3.
What are the key properties of 1-(3,5-dimethylphenyl)-1-(3-propylphenyl)ethanol?
1-(3,5-dimethylphenyl)-1-(3-propylphenyl)ethanol has a molecular weight of 268.40 g/mol, XLogP of 4.51, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,5-dimethylphenyl)-1-(3-propylphenyl)ethanol is sourced from PubChem (CID 116542790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).