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832076-80-9 | Oxazole, 4,5-dimethyl-2-(3,4,5-trimethoxyphenyl)-
CAS No: 832076-80-9 Catalog No: AG00597K MDL No:
Product Description
Catalog Number:
AG00597K
Chemical Name:
Oxazole, 4,5-dimethyl-2-(3,4,5-trimethoxyphenyl)-
CAS Number:
832076-80-9
Molecular Formula:
C14H17NO4
Molecular Weight:
263.2891
IUPAC Name:
4,5-dimethyl-2-(3,4,5-trimethoxyphenyl)-1,3-oxazole
InChI:
InChI=1S/C14H17NO4/c1-8-9(2)19-14(15-8)10-6-11(16-3)13(18-5)12(7-10)17-4/h6-7H,1-5H3
InChI Key:
PVSGRFXZRICUAR-UHFFFAOYSA-N
SMILES:
COc1c(OC)cc(cc1OC)c1oc(c(n1)C)C
Properties
Complexity:
275
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
263.116g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
263.293g/mol
Monoisotopic Mass:
263.116g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
53.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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