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Home > Nitro Compounds > 157671-68-6
157671-68-6 | Peroxide, methylsulfonyl nitro
CAS No: 157671-68-6 Catalog No: AG001PLI MDL No:
Product Description
Catalog Number:
AG001PLI
Chemical Name:
Peroxide, methylsulfonyl nitro
CAS Number:
157671-68-6
Molecular Formula:
CH3NO6S
Molecular Weight:
157.1026
IUPAC Name:
nitrooxy methanesulfonate
InChI:
InChI=1S/CH3NO6S/c1-9(5,6)8-7-2(3)4/h1H3
InChI Key:
IMLJWBRSRKRPAQ-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)OOS(=O)(=O)C
Properties
Complexity:
180
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
156.968g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
157.096g/mol
Monoisotopic Mass:
156.968g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
107A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1
Literature
| Title | Journal |
|---|---|
| OH-initiated oxidation of DMS/DMSO: reaction products at high NOx levels. | Environmental pollution (Barking, Essex : 1987) 20040101 |
| Aerosol formation and reaction pathways of atmospheric oxidation of dimethylsulfide. | Annali di chimica 20010101 |
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