benzene;2-hydroxy-1-phenylethanone

C14H14O2 — CID 174663024

IUPACbenzene;2-hydroxy-1-phenylethanone
SMILESO=C(CO)c1ccccc1.c1ccccc1
InChIInChI=1S/C8H8O2.C6H6/c9-6-8(10)7-4-2-1-3-5-7;1-2-4-6-5-3-1/h1-5,9H,6H2;1-6H
InChIKeyFXBSXXFJEBVADS-UHFFFAOYSA-N
MW214.26 g/mol
LogP2.55
Rot. Bonds2

About benzene;2-hydroxy-1-phenylethanone

benzene;2-hydroxy-1-phenylethanone (PubChem CID 174663024) has the molecular formula C14H14O2 and a molecular weight of 214.26 g/mol. Its IUPAC name is benzene;2-hydroxy-1-phenylethanone.

Molecular Properties

Compound Namebenzene;2-hydroxy-1-phenylethanone
PubChem CID174663024
Molecular FormulaC14H14O2
Molecular Weight214.26 g/mol
Exact Mass214.10
IUPAC Namebenzene;2-hydroxy-1-phenylethanone
SMILESO=C(CO)c1ccccc1.c1ccccc1
InChIInChI=1S/C8H8O2.C6H6/c9-6-8(10)7-4-2-1-3-5-7;1-2-4-6-5-3-1/h1-5,9H,6H2;1-6H
InChIKeyFXBSXXFJEBVADS-UHFFFAOYSA-N
XLogP2.55
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.26
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

azane;2-hydroxy-1-phenylethanone
CID 161228887
butanoic acid;2-hydroxy-1-phenylethanone
CID 175969128
2-hydroxy-1-phenylethanone;2-methylpropane-1,2-diamine
CID 159852877
1,3-diphenylpropane-1,3-dione;dihydrofluoride
CID 159485423
bis(1,3-diphenylpropane-1,3-dione);zinc
CID 67929938
1-[4-benzoyl-3,5-bis(2-hydroxyacetyl)phenyl]-2-hydroxyethanone
CID 174566620
1-(4-benzoyliodanuidylsulfanylphenyl)-2-hydroxyethanone
CID 163744070
1-phenyl(111C)propan-1-one
CID 11159350
CID 173152165
CID 173152165
tetrakis(2,4-dioxo-4-phenylbutanoic acid);zirconium(4+)
CID 175883253
3-hydroxy-2-(hydroxymethyl)-3-phenylprop-2-enoic acid
CID 67077320
ethane;3-hydroxy-1-phenylpropan-1-one
CID 90864393

Frequently Asked Questions

What is the IUPAC name of benzene;2-hydroxy-1-phenylethanone?
The IUPAC name of benzene;2-hydroxy-1-phenylethanone (CID 174663024) is benzene;2-hydroxy-1-phenylethanone.
What is the SMILES notation for benzene;2-hydroxy-1-phenylethanone?
The canonical SMILES for benzene;2-hydroxy-1-phenylethanone is O=C(CO)c1ccccc1.c1ccccc1.
What is the InChIKey of benzene;2-hydroxy-1-phenylethanone?
The InChIKey is FXBSXXFJEBVADS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8O2.C6H6/c9-6-8(10)7-4-2-1-3-5-7;1-2-4-6-5-3-1/h1-5,9H,6H2;1-6H.
What are the key properties of benzene;2-hydroxy-1-phenylethanone?
benzene;2-hydroxy-1-phenylethanone has a molecular weight of 214.26 g/mol, XLogP of 2.55, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for benzene;2-hydroxy-1-phenylethanone is sourced from PubChem (CID 174663024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).