chempirical

Mecarbam

C10H20NO5PS2CAS 2595-54-2329.37 g/mol

Open in Covalent MOL file
OONOSPSOO
AmideCarbamate

Properties

Molecular formula
C10H20NO5PS2
Molar mass
329.37 g/mol
Exact mass
329.0521 Da
Density
1.222 g/mL (at 20 °C)
Melting point
below 25 °C
Boiling point
144 °C (at 0.02 Torr)
logP
2.63Crippen estimate
Polar surface area
65.1 Ų
H-bond donors / acceptors
0 / 7
Rotatable bonds
8

Identifiers

CAS number
2595-54-2
SMILES
CCOC(=O)N(C)C(=O)CSP(=S)(OCC)OCC
InChIKey
KLGMSAOQDHLCOS-UHFFFAOYSA-N
InChI
InChI=1S/C10H20NO5PS2/c1-5-14-10(13)11(4)9(12)8-19-17(18,15-6-2)16-7-3/h5-8H2,1-4H3

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Names and synonyms

12 names
  • 7-Oxa-5-thia-2-aza-6-phosphanonanoic acid, 6-ethoxy-2-methyl-3-oxo-, ethyl ester, 6-sulfide
  • Carbamic acid, (mercaptoacetyl)methyl-, ethyl ester, S-ester with O,O-diethyl phosphorodithioate
  • Carbamic acid, (mercaptoacetyl)methyl-, ethyl ester, O,O-diethyl phosphorodithioate
  • MS 1053
  • MS 1143
  • O,O-Diethyl S-(N-ethoxycarbonyl-N-methylcarbamoylmethyl) phosphorodithioate
  • O,O-Diethyl S-(N-ethoxycarbonyl-N-methylcarbamoylmethyl) phosphorothiolothionate
  • Pestan
  • Murfotox
  • TD 72
  • Pennsalt TD 72
  • Criotox

Work with Mecarbam

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Ethion563-12-243 % similar Chlormephos24934-91-640 % similar Prothoate2275-18-539 % similar Formothion2540-82-139 % similar Phorate298-02-238 % similar Disulfoton298-04-437 % similar Terbufos13071-79-936 % similar Ethyl N-methyl-N-phenylcarbamate2621-79-635 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

PubChem CAS Common Chemistry NIST WebBook