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35624-96-5 | 2-(3,4,5-Trimethoxythiobenzoyl)isoxazolidine
CAS No: 35624-96-5 Catalog No: AG00D29F MDL No:
Product Description
Catalog Number:
AG00D29F
Chemical Name:
2-(3,4,5-Trimethoxythiobenzoyl)isoxazolidine
CAS Number:
35624-96-5
IUPAC Name:
1,2-oxazolidin-2-yl-(3,4,5-trimethoxyphenyl)methanethione
InChI:
InChI=1S/C13H17NO4S/c1-15-10-7-9(8-11(16-2)12(10)17-3)13(19)14-5-4-6-18-14/h7-8H,4-6H2,1-3H3
InChI Key:
LCRAPMXTTIIICC-UHFFFAOYSA-N
Properties
Complexity:
301
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
283.088g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
283.342g/mol
Monoisotopic Mass:
283.088g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
72.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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