ethane;2-hydroxy-2,2-diphenylacetic acid

C16H18O3 — CID 143307418

IUPACethane;2-hydroxy-2,2-diphenylacetic acid
SMILESCC.O=C(O)C(O)(c1ccccc1)c1ccccc1
InChIInChI=1S/C14H12O3.C2H6/c15-13(16)14(17,11-7-3-1-4-8-11)12-9-5-2-6-10-12;1-2/h1-10,17H,(H,15,16);1-2H3
InChIKeyQGSAEZHFYQFCCD-UHFFFAOYSA-N
MW258.32 g/mol
LogP3.03
Rot. Bonds3

About ethane;2-hydroxy-2,2-diphenylacetic acid

ethane;2-hydroxy-2,2-diphenylacetic acid (PubChem CID 143307418) has the molecular formula C16H18O3 and a molecular weight of 258.32 g/mol. Its IUPAC name is ethane;2-hydroxy-2,2-diphenylacetic acid.

Molecular Properties

Compound Nameethane;2-hydroxy-2,2-diphenylacetic acid
PubChem CID143307418
Molecular FormulaC16H18O3
Molecular Weight258.32 g/mol
Exact Mass258.13
IUPAC Nameethane;2-hydroxy-2,2-diphenylacetic acid
SMILESCC.O=C(O)C(O)(c1ccccc1)c1ccccc1
InChIInChI=1S/C14H12O3.C2H6/c15-13(16)14(17,11-7-3-1-4-8-11)12-9-5-2-6-10-12;1-2/h1-10,17H,(H,15,16);1-2H3
InChIKeyQGSAEZHFYQFCCD-UHFFFAOYSA-N
XLogP3.03
TPSA57.53 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 53.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

CID 161419410
CID 161419410
2,2-bis(4-tert-butylphenyl)-2-hydroxyacetic acid
CID 23377158
(2R)-2-hydroxy-2-phenylpropanoic acid
CID 736858
CID 6328820
CID 6328820
2-hydroxy-2-phenyl-2-(3,4,5-trimethoxyphenyl)acetic acid
CID 139609935
3-hydroxy-2,2-dimethyl-3-phenylbutanoic acid
CID 12570468
2-hydroxy-2-methylpropanoic acid;2-hydroxy-2-phenylpropanoic acid
CID 70572731
1-azabicyclo[2.2.2]octane;2-hydroxy-2,2-diphenylacetic acid
CID 5311391
(2R,3R)-2,3-dihydroxy-2,3-diphenylbutanedioic acid
CID 101336799
(2S,3S)-2,3-dihydroxy-2,3-diphenylbutanedioic acid
CID 101336800
2-hydroxy-2,2-diphenylacetate;hydrochloride
CID 21418239
magnesium;hydride;2-methyl-2-phenylpropanoic acid
CID 174669783

Frequently Asked Questions

What is the IUPAC name of ethane;2-hydroxy-2,2-diphenylacetic acid?
The IUPAC name of ethane;2-hydroxy-2,2-diphenylacetic acid (CID 143307418) is ethane;2-hydroxy-2,2-diphenylacetic acid.
What is the SMILES notation for ethane;2-hydroxy-2,2-diphenylacetic acid?
The canonical SMILES for ethane;2-hydroxy-2,2-diphenylacetic acid is CC.O=C(O)C(O)(c1ccccc1)c1ccccc1.
What is the InChIKey of ethane;2-hydroxy-2,2-diphenylacetic acid?
The InChIKey is QGSAEZHFYQFCCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12O3.C2H6/c15-13(16)14(17,11-7-3-1-4-8-11)12-9-5-2-6-10-12;1-2/h1-10,17H,(H,15,16);1-2H3.
What are the key properties of ethane;2-hydroxy-2,2-diphenylacetic acid?
ethane;2-hydroxy-2,2-diphenylacetic acid has a molecular weight of 258.32 g/mol, XLogP of 3.03, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;2-hydroxy-2,2-diphenylacetic acid is sourced from PubChem (CID 143307418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).