Home Halogens Phosphorothioic acid,S-[(6-chloro-2-oxooxazolo[4,5-b]pyridin-3(2H)-yl)methyl] O,O-dimethylester

Phosphorothioic acid,S-[(6-chloro-2-oxooxazolo[4,5-b]pyridin-3(2H)-yl)methyl] O,O-dimethylester

CAS No.:
35575-96-3
Catalog Number:
AG00I724
Molecular Formula:
C9H10ClN2O5PS
Molecular Weight:
324.6779
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%(HPLC)
In Stock USA
United States
$54
- +
1g
95%(HPLC)
In Stock USA
United States
$126
- +
5g
95%(HPLC)
In Stock USA
United States
$504
- +
Product Description
Catalog Number:
AG00I724
Chemical Name:
Phosphorothioic acid,S-[(6-chloro-2-oxooxazolo[4,5-b]pyridin-3(2H)-yl)methyl] O,O-dimethylester
CAS Number:
35575-96-3
Molecular Formula:
C9H10ClN2O5PS
Molecular Weight:
324.6779
MDL Number:
MFCD00867611
IUPAC Name:
6-chloro-3-(dimethoxyphosphorylsulfanylmethyl)-[1,3]oxazolo[4,5-b]pyridin-2-one
InChI:
InChI=1S/C9H10ClN2O5PS/c1-15-18(14,16-2)19-5-12-8-7(17-9(12)13)3-6(10)4-11-8/h3-4H,5H2,1-2H3
InChI Key:
VNKBTWQZTQIWDV-UHFFFAOYSA-N
SMILES:
COP(=O)(SCn1c(=O)oc2c1ncc(c2)Cl)OC
EC Number:
252-626-0
UNII:
9440R8149U
Properties
Complexity:
393  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
323.974g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
324.672g/mol
Monoisotopic Mass:
323.974g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
103A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Literature
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