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50915-99-6 | 3-(3,4,5-TRIMETHOXYBENZOYL)-2-OXAZOLIDINONE
CAS No: 50915-99-6 Catalog No: AG006VCQ MDL No:
Product Description
Catalog Number:
AG006VCQ
Chemical Name:
3-(3,4,5-TRIMETHOXYBENZOYL)-2-OXAZOLIDINONE
CAS Number:
50915-99-6
Molecular Formula:
C13H15NO6
Molecular Weight:
281.2613
IUPAC Name:
3-(3,4,5-trimethoxybenzoyl)-1,3-oxazolidin-2-one
InChI:
InChI=1S/C13H15NO6/c1-17-9-6-8(7-10(18-2)11(9)19-3)12(15)14-4-5-20-13(14)16/h6-7H,4-5H2,1-3H3
InChI Key:
ZWMIIIHUIXPCEP-UHFFFAOYSA-N
SMILES:
COc1cc(cc(c1OC)OC)C(=O)N1CCOC1=O
Properties
Complexity:
360
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
281.09g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
281.264g/mol
Monoisotopic Mass:
281.09g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
74.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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