O-Methyl O-(4-nitrophenyl) carbonothioate structure

O-Methyl O-(4-nitrophenyl) carbonothioate

methoxy-(4-nitrophenoxy)methanethione

Also Known As: methoxy-(4-nitrophenoxy)methanethione|methyl 4-nitrophenyl thionocarbonate|O-Methyl O-(4-nitrophenyl) carbonothioate|METHOXY(4-NITROPHENOXY)METHANETHIONE|Carbonothioic acid,O-methyl O-(4-nitrophenyl) ester|Thiocarbonic acid O-methyl O-(4-nitrophenyl) ester

CAS: 1014-94-4
Molecular Formula C8H7NO4S
Molecular Weight 213.00958 g/mol
LogP 2.5
Topological Polar Surface Area 96.4 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 5
Rotatable Bonds 3
Exact Mass 213.00958
Monoisotopic Mass 213.00958
Heavy Atoms 14
Complexity 220.0

Chemical Identifiers

CAS Number 1014-94-4
SMILES COC(=S)OC1=CC=C(C=C1)[N+](=O)[O-]
InChIKey NVWVRLADZILTJW-UHFFFAOYSA-N

Product Overview

O-Methyl O-(4-nitrophenyl) carbonothioate (CAS 1014-94-4), with molecular formula C8H7NO4S and molecular weight 213.00958 g/mol. IUPAC: methoxy-(4-nitrophenoxy)methanethione.

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