2-cyclohexyl-2-(2-hydroxyphenyl)acetic acid

C14H18O3 — CID 22178850

IUPAC2-cyclohexyl-2-(2-hydroxyphenyl)acetic acid
SMILESO=C(O)C(c1ccccc1O)C1CCCCC1
InChIInChI=1S/C14H18O3/c15-12-9-5-4-8-11(12)13(14(16)17)10-6-2-1-3-7-10/h4-5,8-10,13,15H,1-3,6-7H2,(H,16,17)
InChIKeyPSZIEAPSBYKIOL-UHFFFAOYSA-N
MW234.29 g/mol
LogP3.14
Rot. Bonds3

About 2-cyclohexyl-2-(2-hydroxyphenyl)acetic acid

2-cyclohexyl-2-(2-hydroxyphenyl)acetic acid (PubChem CID 22178850) has the molecular formula C14H18O3 and a molecular weight of 234.29 g/mol. Its IUPAC name is 2-cyclohexyl-2-(2-hydroxyphenyl)acetic acid.

Molecular Properties

Compound Name2-cyclohexyl-2-(2-hydroxyphenyl)acetic acid
PubChem CID22178850
Molecular FormulaC14H18O3
Molecular Weight234.29 g/mol
Exact Mass234.13
IUPAC Name2-cyclohexyl-2-(2-hydroxyphenyl)acetic acid
SMILESO=C(O)C(c1ccccc1O)C1CCCCC1
InChIInChI=1S/C14H18O3/c15-12-9-5-4-8-11(12)13(14(16)17)10-6-2-1-3-7-10/h4-5,8-10,13,15H,1-3,6-7H2,(H,16,17)
InChIKeyPSZIEAPSBYKIOL-UHFFFAOYSA-N
XLogP3.14
TPSA57.53 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.29
LogP ≤ 53.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-bromophenyl)-2-cycloheptylacetic acid
CID 82929403
2-(2-hydroxyphenyl)-2-(oxan-4-yl)acetic acid
CID 105497526
2-cyclobutyl-2-(2-methylphenyl)acetic acid
CID 83687024
(1,1-dimethylpiperidin-1-ium-4-yl) 2-cyclopentyl-2-(2-hydroxyphenyl)acetate bromide
CID 66605372
2-[(S)-amino(cyclopentyl)methyl]phenol
CID 130665653
2-(1-cyclohexyl-2,2-difluoroethyl)phenol
CID 115043682
(2R)-2-cyclohexyl-2-phenylacetate
CID 6931336
2-(1-cyclohexylethyl)benzoic acid
CID 115038988
(2S)-2-(4-bromo-2-fluorophenyl)-2-cyclopentylacetic acid
CID 125466606
2-cyclopentyl-2-phenylacetic acid;2-(2-hydroxyethoxy)ethanol
CID 175204467
2-cyclohexyl-2-phenylethanethioamide
CID 82082945
2-(cyclohexylamino)-2-(2-cyclopropylphenyl)acetic acid
CID 79982392

Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-2-(2-hydroxyphenyl)acetic acid?
The IUPAC name of 2-cyclohexyl-2-(2-hydroxyphenyl)acetic acid (CID 22178850) is 2-cyclohexyl-2-(2-hydroxyphenyl)acetic acid.
What is the SMILES notation for 2-cyclohexyl-2-(2-hydroxyphenyl)acetic acid?
The canonical SMILES for 2-cyclohexyl-2-(2-hydroxyphenyl)acetic acid is O=C(O)C(c1ccccc1O)C1CCCCC1.
What is the InChIKey of 2-cyclohexyl-2-(2-hydroxyphenyl)acetic acid?
The InChIKey is PSZIEAPSBYKIOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18O3/c15-12-9-5-4-8-11(12)13(14(16)17)10-6-2-1-3-7-10/h4-5,8-10,13,15H,1-3,6-7H2,(H,16,17).
What are the key properties of 2-cyclohexyl-2-(2-hydroxyphenyl)acetic acid?
2-cyclohexyl-2-(2-hydroxyphenyl)acetic acid has a molecular weight of 234.29 g/mol, XLogP of 3.14, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-2-(2-hydroxyphenyl)acetic acid is sourced from PubChem (CID 22178850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).