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72987-33-8 | 2-methyl-6-benzoxazol-1-yl phenyl ketone
CAS No: 72987-33-8 Catalog No: AG00FVWZ MDL No:
Product Description
Catalog Number:
AG00FVWZ
Chemical Name:
2-methyl-6-benzoxazol-1-yl phenyl ketone
CAS Number:
72987-33-8
IUPAC Name:
(2-methyl-1,3-benzoxazol-6-yl)-phenylmethanone
InChI:
InChI=1S/C15H11NO2/c1-10-16-13-8-7-12(9-14(13)18-10)15(17)11-5-3-2-4-6-11/h2-9H,1H3
InChI Key:
OMYCUQIDXCNEHW-UHFFFAOYSA-N
EC Number:
277-182-5
Properties
Complexity:
312
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
237.079g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
237.258g/mol
Monoisotopic Mass:
237.079g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
43.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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