Methylnitrosocarbamic acid p-((dimethylamino)methyleneamino)phenyl ester
Basic information
- CAS
100836-59-7- Standard SMILES
CN(C)C=Nc1ccc(OC(=O)N(C)N=O)cc1- InChIKey
OLFJEWKCCYHVLE-UHFFFAOYSA-N- Molecular formula
- C11H14N4O3
- Average molar mass
- 250.25 g/mol
- Monoisotopic mass
- 250.10659032
Names & identifiers
- Preferred name
- Methylnitrosocarbamic acid p-((dimethylamino)methyleneamino)phenyl ester
- IUPAC
- [4-(dimethylaminomethylideneamino)phenyl] N-methyl-N-nitrosocarbamate
- English name
- Methylnitrosocarbamic acid p-((dimethylamino)methyleneamino)phenyl est er
- Molecular formula
- C11H14N4O3
- Molecular weight
- 250.25
Names & synonyms
100836-59-7Formelanate nitroso[4-(dimethylaminomethylideneamino)phenyl] N-methyl-N-nitrosocarbamateMethylnitrosocarbamic acid p-((dimethylamino)methyleneamino)phenyl esterCARBAMIC ACID, METHYLNITROSO-, p-((DIMETHYLAMINO)METHYLENEAMINO)PHENYL ESTERMethylnitrosocarbamic acid p-((dimethylamino)methyleneamino)phenyl est er[4-(Dimethylaminomethylideneamino)phenyl]n-methyl-N-nitrosocarbamateCarbamic acid, methylnitroso-, 4-[[(dimethylamino)methylene]amino]phenyl ester (9CI)
Database identifiers
- CAS
100836-59-7- PubChem CID
- 58045
- Nikkaji
- J69.515G
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 74.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 311
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Compound notes
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