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898784-52-6 | 2-(3,5-Dimethoxybenzoyl)oxazole
CAS No: 898784-52-6 Catalog No: AG00GX3X MDL No:
Product Description
Catalog Number:
AG00GX3X
Chemical Name:
2-(3,5-Dimethoxybenzoyl)oxazole
CAS Number:
898784-52-6
Molecular Formula:
C12H11NO2
Molecular Weight:
201.2212
IUPAC Name:
(3,5-dimethylphenyl)-(1,3-oxazol-2-yl)methanone
InChI:
InChI=1S/C12H11NO2/c1-8-5-9(2)7-10(6-8)11(14)12-13-3-4-15-12/h3-7H,1-2H3
InChI Key:
JSWGMEGDGPFYTL-UHFFFAOYSA-N
SMILES:
Cc1cc(C)cc(c1)C(=O)c1ncco1
Properties
Complexity:
232
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
201.079g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
201.225g/mol
Monoisotopic Mass:
201.079g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
43.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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