Basic information
- CAS
58139-34-7- Standard SMILES
Cc1cc(C)cc(OC(=O)N(C)N=O)c1- InChIKey
LNHCDFPBNISRKG-UHFFFAOYSA-N- Molecular formula
- C10H12N2O3
- Average molar mass
- 208.21 g/mol
- Monoisotopic mass
- 208.08479225
Names & identifiers
- Preferred name
- 3,5-Dimethylphenyl methylnitrosocarbamate
- IUPAC
- (3,5-dimethylphenyl) N-methyl-N-nitrosocarbamate
Names & synonyms
58139-34-73,5-Dimethylphenyl methylnitrosocarbamateN-Nitroso-3,5-xylyl-N-methylcarbamateCARBAMIC ACID, METHYLNITROSO-, 3,5-XYLYL ESTERMaqbarl, nitrosated [Japanese]Maqbarl, nitrosatedCCRIS 1223(3,5-dimethylphenyl) N-methyl-N-nitrosocarbamate3,5-Xylyl N-methylcarbamate, nitrosatedCarbamic acid, methylnitroso-, 3,5-dimethylphenyl esterDTXSID0020686828685K5B6Z
Show more names
3,5-Dimethylphenyl methyl(nitroso)carbamateDIMETHYLPHENYL METHYLNITROSOCARBAMATE, 3,5-
Database identifiers
- CAS
58139-34-7- PubChem CID
- 42645
- DTXSID
DTXSID00206868- UNII
- 28685K5B6Z
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 59 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 235
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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