3-Hydroxybenzophenone
Product Information
Molecular Formula
C13H10O2
Molecular Weight
198.22
Description
The antioxidant properties of 3-Hydroxybenzophenone coupled with its effective properties as a UV absorber make it indispensable in numerous pharmaceutical applications, especially in the manufacture of sunscreens.
Synonyms
(3-Hydroxyphenyl)(phenyl)methanone; Methanone, (3-hydroxyphenyl)phenyl-; M-HYDROXYBENZOPHENONE; 3-HYDROXYBENZOPHENONE; M-BENZOYL PHENOL; 3-Hydroxybenzophenone,99%
IUPAC Name
(3-hydroxyphenyl)-phenylmethanone
SMILES
C1=CC=C(C=C1)C(=O)C2=CC(=CC=C2)O
InChI
InChI=1S/C13H10O2/c14-12-8-4-7-11(9-12)13(15)10-5-2-1-3-6-10/h1-9,14H
InChI Key
SHULEACXTONYPS-UHFFFAOYSA-N
Boiling Point
373.7°C at 760 mmHg
Melting Point
117-119°C
Flash Point
235.4 °F
Purity
95%
Density
1.194 g/cm3
Appearance
light beige solid.
Storage
2-8°C
Safety Information
Hazards
H315:
Causes skin irritation.
H319:
Causes serious eye irritation.
Causes skin irritation.
H319:
Causes serious eye irritation.
Precautionary Statement
P264:
Wash thoroughly after handling.
P280:
Wear protective gloves/protective clothing/eye protection/face protection.
P302+P352:
IF ON SKIN:
Wash with plenty of soap and water.
P332+P313:
If skin irritation occurs:
Get medical advice/attention.
P337+P313:
If eye irritation persists:
Get medical advice/attention.
P362+P364:
Take off contaminated clothing. [As modified by IV ATP].
And wash it before reuse. [Added by IV ATP].
Wash thoroughly after handling.
P280:
Wear protective gloves/protective clothing/eye protection/face protection.
P302+P352:
IF ON SKIN:
Wash with plenty of soap and water.
P332+P313:
If skin irritation occurs:
Get medical advice/attention.
P337+P313:
If eye irritation persists:
Get medical advice/attention.
P362+P364:
Take off contaminated clothing. [As modified by IV ATP].
And wash it before reuse. [Added by IV ATP].
Computed Properties
XLogP3
3
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
2
Rotatable Bond Count
2
Exact Mass
198.068079557 g/mol
Monoisotopic Mass
198.068079557 g/mol
Topological Polar Surface Area
37.3Ų
Heavy Atom Count
15
Formal Charge
0
Complexity
219
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
1
Compound Is Canonicalized
Yes
