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782503-75-7 | (Z)-4-(2,4-Dimethoxybenzylidene)-2-methyloxazol-5(4H)-one
CAS No: 782503-75-7 Catalog No: AG0054AM MDL No:MFCD00445012
Product Description
Catalog Number:
AG0054AM
Chemical Name:
(Z)-4-(2,4-Dimethoxybenzylidene)-2-methyloxazol-5(4H)-one
CAS Number:
782503-75-7
Molecular Formula:
C13H13NO4
Molecular Weight:
247.2466
MDL Number:
MFCD00445012
IUPAC Name:
4-[(2,4-dimethoxyphenyl)methylidene]-2-methyl-1,3-oxazol-5-one
InChI:
InChI=1S/C13H13NO4/c1-8-14-11(13(15)18-8)6-9-4-5-10(16-2)7-12(9)17-3/h4-7H,1-3H3
InChI Key:
YMXHZKCZYAJCTI-UHFFFAOYSA-N
SMILES:
COc1cc(OC)ccc1/C=C/1\N=C(OC1=O)C
Properties
Complexity:
389
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.084g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
247.25g/mol
Monoisotopic Mass:
247.084g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
57.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
1.8
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