ChemicalBook--->CAS DataBase List--->13020-57-0

13020-57-0

13020-57-0 Structure

13020-57-0 Structure
IdentificationMore
[Name]

3-HYDROXYBENZOPHENONE
[CAS]

13020-57-0
[Synonyms]

3-HYDROXYBENZOPHENONE
M-BENZOYL PHENOL
M-HYDROXYBENZOPHENONE
(3-Hydroxyphenyl)(phenyl)methanone
Methanone, (3-hydroxyphenyl)phenyl-
[EINECS(EC#)]

235-879-1
[Molecular Formula]

C13H10O2
[MDL Number]

MFCD00002297
[Molecular Weight]

198.22
[MOL File]

13020-57-0.mol
Chemical PropertiesBack Directory
[Appearance]

light beige to brown-grey crystalline powder
[Melting point ]

113-115 °C (lit.)
[Boiling point ]

295.53°C (rough estimate)
[density ]

1.1184 (rough estimate)
[refractive index ]

1.5954 (estimate)
[storage temp. ]

Inert atmosphere,Room Temperature
[solubility ]

Soluble in Chloroform, DCM. Ethyl Acetate.
[form ]

Solid
[pka]

9.18±0.10(Predicted)
[color ]

White
[λmax]

315nm(EtOH)(lit.)
[InChI]

1S/C13H10O2/c14-12-8-4-7-11(9-12)13(15)10-5-2-1-3-6-10/h1-9,14H
[InChIKey]

SHULEACXTONYPS-UHFFFAOYSA-N
[SMILES]

Oc1cccc(c1)C(=O)c2ccccc2
[CAS DataBase Reference]

13020-57-0(CAS DataBase Reference)
[NIST Chemistry Reference]

M-hydroxybenzophenone(13020-57-0)
Safety DataBack Directory
[Hazard Codes ]

Xi
[Risk Statements ]

R36/37/38:Irritating to eyes, respiratory system and skin .
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S37/39:Wear suitable gloves and eye/face protection .
S36:Wear suitable protective clothing .
[WGK Germany ]

3
[RTECS ]

PC4959730
[HazardClass ]

IRRITANT
[HS Code ]

29145090
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Eye Irrit. 2
Skin Irrit. 2
STOT SE 3
Hazard InformationBack Directory
[Chemical Properties]

light beige to brown-grey crystalline powder
[Uses]

3-Hydroxybenzophenone is a benzophenone metabolite with potential estrogenic and anti-androgenic activity. is a more attractive hydrogen bonding co-material for MCPBA, as the 3-hydroxyl group is unable to form an intramolecular hydrogen bond. It is commonly used as a radical and cationic photo initiators.
[Preparation]

Preparation by aromatization of 5-benzoyl-2- cyclohexenone,
? in the presence of 10% Pd/C in refluxing xylene for 6 h (60%)
? in the presence of lithium bromide and cupric bromide in refluxing acetonitrile for 1 h (75%).
Spectrum DetailBack Directory
[Spectrum Detail]

3-HYDROXYBENZOPHENONE(13020-57-0)1HNMR
3-HYDROXYBENZOPHENONE(13020-57-0)IR1
3-HYDROXYBENZOPHENONE(13020-57-0)IR2
3-HYDROXYBENZOPHENONE(13020-57-0)Raman
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

3-Hydroxybenzophenone, 99%(13020-57-0)
[Alfa Aesar]

3-Hydroxybenzophenone, 99%(13020-57-0)
[Sigma Aldrich]

13020-57-0(sigmaaldrich)
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