CAS 574-19-6|2'-Hydroxy-1'-acetonaphthone|(2-Hydroxynaphthen-1-yl)ethan-1-one|1-(2-hydroxynaphthalen-1-yl)ethan-1-one|1-(2-hydroxynaphthalen-1-yl)ethanone|2′-Hydroxy-1′-acetonaphthone|1-Acetyl-2-n...

General Information

Structure

Molecular Formula

C₁₂H₁₀O₂

Molecular Mass

186.2066

Exact Mass

186.06807956

Charge

InChI

InChI=1S/C12H10O2/c1-8(13)12-10-5-3-2-4-9(10)6-7-11(12)14/h2-7,14H,1H3

InChIKey

VUIOUIWZVKVFCI-UHFFFAOYSA-N

Canonic Smiles

CC(=O)c1c(O)ccc2c1cccc2

Isomeric Smiles

O=C(c1c(ccc2c1cccc2)O)C

Calculated Properties

JChem

Acid pKa

8.953447

H Acceptors

H Donor

LogD (pH = 5.5)

2.866653

LogD (pH = 7.4)

2.8549185

Log P

2.8668048

Molar Refractivity

54.8919

Polarizability

22.21455

Polar Surface Area

37.3

Rotatable Bonds

Lipinski's Rule of Five

true

Data Source

Names and Identifiers

Synonyms

2'-Hydroxy-1'-acetonaphthone(2-Hydroxynaphthen-1-yl)ethan-1-one2′-Hydroxy-1′-acetonaphthone1-Acetyl-2-naphthol1-乙酰基-2-萘酚2-羟基-1-萘乙酮1-(2-hydroxy-1-naphthyl)ethan-1-one1-Acetyl-2-hydroxynaphthalene1-Acetyl-2-naphthol2'-Hydroxy-1'-acetonaphthone

IUPAC name

1-(2-hydroxynaphthalen-1-yl)ethan-1-one

IUPAC Traditional name

1-(2-hydroxynaphthalen-1-yl)ethanone

Names and Identifiers

Registration numbers

MDL Number

MFCD00012131

EC Number

209-369-4

CAS Number

574-19-6