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2-Hydroxy-5-methylbenzophenone

CAT: 0926-FH70599-02Size: 0.025 kgDry Ice: NoHazardous: No
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CAT#:0926-FH70599-02Size:0.025 kg
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CAS Number
1470-57-1
MDL Number
MFCD00002379
Smiles
CC1=CC (=C (C=C1) O) C (=O) C2=CC=CC=C2
Molecular Formula
C14H12O2
Molecular Weight
212.24 g/mol
Controlled
No

Chemical Information

2-Hydroxy-5-methylbenzophenone
CAS Number1470-57-1
PubChem CID73851
IUPAC Name(2-hydroxy-5-methylphenyl)-phenylmethanone
Molecular FormulaC14H12O2
Molecular Weight212.24
XLogP3.9
Topological Polar Surface Area37.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Heavy Atom Count16
Formal Charge0
Complexity243
SMILES
CC1=CC(=C(C=C1)O)C(=O)C2=CC=CC=C2
InChI
InChI=1S/C14H12O2/c1-10-7-8-13(15)12(9-10)14(16)11-5-3-2-4-6-11/h2-9,15H,1H3
InChIKey
OQERFUGURPLBQH-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-Hydroxy-5-methylbenzophenone
CAS: 1470-57-1
CID: 73851
Formula: C14H12O2
MW: 212.24
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight212.24
XLogP33.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Exact Mass212.083729621
Monoisotopic Mass212.083729621
Topological Polar Surface Area37.3 Ų
Heavy Atom Count16
Formal Charge0
Complexity243
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes