1-(4-hydroxyphenyl)ethanone;4-(1-methylcyclopropyl)phenol

C18H20O3 — CID 161486309

IUPAC1-(4-hydroxyphenyl)ethanone;4-(1-methylcyclopropyl)phenol
SMILESCC(=O)c1ccc(O)cc1.CC1(c2ccc(O)cc2)CC1
InChIInChI=1S/C10H12O.C8H8O2/c1-10(6-7-10)8-2-4-9(11)5-3-8;1-6(9)7-2-4-8(10)5-3-7/h2-5,11H,6-7H2,1H3;2-5,10H,1H3
InChIKeyWFADERCASMSBLB-UHFFFAOYSA-N
MW284.36 g/mol
LogP4.04
Rot. Bonds2

About 1-(4-hydroxyphenyl)ethanone;4-(1-methylcyclopropyl)phenol

1-(4-hydroxyphenyl)ethanone;4-(1-methylcyclopropyl)phenol (PubChem CID 161486309) has the molecular formula C18H20O3 and a molecular weight of 284.36 g/mol. Its IUPAC name is 1-(4-hydroxyphenyl)ethanone;4-(1-methylcyclopropyl)phenol.

Molecular Properties

Compound Name1-(4-hydroxyphenyl)ethanone;4-(1-methylcyclopropyl)phenol
PubChem CID161486309
Molecular FormulaC18H20O3
Molecular Weight284.36 g/mol
Exact Mass284.14
IUPAC Name1-(4-hydroxyphenyl)ethanone;4-(1-methylcyclopropyl)phenol
SMILESCC(=O)c1ccc(O)cc1.CC1(c2ccc(O)cc2)CC1
InChIInChI=1S/C10H12O.C8H8O2/c1-10(6-7-10)8-2-4-9(11)5-3-8;1-6(9)7-2-4-8(10)5-3-7/h2-5,11H,6-7H2,1H3;2-5,10H,1H3
InChIKeyWFADERCASMSBLB-UHFFFAOYSA-N
XLogP4.04
TPSA57.53 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 54.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(4-hydroxyphenyl)(211C)ethanone
CID 177408736
1-(4-hydroxyphenyl)ethanone;phosphane
CID 145192657
1-(1-methylcyclopropyl)-4-prop-1-en-2-ylbenzene
CID 145094183
butane;1-(4-hydroxyphenyl)ethanone
CID 142352310
1-[4-(2-methyl-1,3-dioxolan-2-yl)phenyl]ethanone
CID 10845946
1-(4-acetylphenyl)ethanone;methane
CID 159515104
1-[4-(1-hydroxy-3,3-dimethylcyclohexyl)phenyl]ethanone
CID 22390427
4-[4-(hydroxymethyl)-1-methylcyclohexyl]phenol
CID 166817509
1-(4-hydroxyphenyl)ethanone;propane-1,2,3-triol
CID 174948950
[1-(4-hydroxyphenyl)cyclopentyl] 2-methylprop-2-enoate
CID 168800149
1-[4-(1-amino-4,4-difluorocyclohexyl)phenyl]ethanone
CID 156734547
4-(4-hydroxyphenyl)-4-methyloxolan-2-one
CID 105445803

Frequently Asked Questions

What is the IUPAC name of 1-(4-hydroxyphenyl)ethanone;4-(1-methylcyclopropyl)phenol?
The IUPAC name of 1-(4-hydroxyphenyl)ethanone;4-(1-methylcyclopropyl)phenol (CID 161486309) is 1-(4-hydroxyphenyl)ethanone;4-(1-methylcyclopropyl)phenol.
What is the SMILES notation for 1-(4-hydroxyphenyl)ethanone;4-(1-methylcyclopropyl)phenol?
The canonical SMILES for 1-(4-hydroxyphenyl)ethanone;4-(1-methylcyclopropyl)phenol is CC(=O)c1ccc(O)cc1.CC1(c2ccc(O)cc2)CC1.
What is the InChIKey of 1-(4-hydroxyphenyl)ethanone;4-(1-methylcyclopropyl)phenol?
The InChIKey is WFADERCASMSBLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12O.C8H8O2/c1-10(6-7-10)8-2-4-9(11)5-3-8;1-6(9)7-2-4-8(10)5-3-7/h2-5,11H,6-7H2,1H3;2-5,10H,1H3.
What are the key properties of 1-(4-hydroxyphenyl)ethanone;4-(1-methylcyclopropyl)phenol?
1-(4-hydroxyphenyl)ethanone;4-(1-methylcyclopropyl)phenol has a molecular weight of 284.36 g/mol, XLogP of 4.04, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-hydroxyphenyl)ethanone;4-(1-methylcyclopropyl)phenol is sourced from PubChem (CID 161486309), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).