Basic information
- CAS
36851-80-6- Standard SMILES
NC(=O)NCN=O- InChIKey
RHGYANGWZZFRIJ-UHFFFAOYSA-N- Molecular formula
- C2H5N3O2
- Average molar mass
- 103.08 g/mol
- Monoisotopic mass
- 103.0381764
Names & identifiers
- Preferred name
- Urea, (nitrosomethyl)-
- IUPAC
- nitrosomethylurea
- English name
- Urea, (nitrosomethyl)-
- Molecular formula
- C2H5N3O2
- Molecular weight
- 103.08
Names & synonyms
Urea, (nitrosomethyl)-36851-80-6DTXSID90190328RefChem:387136DTXCID00112819NitrosomethylureaNitrosomethyl ureaN-NitrosomethylureaN-(Nitrosomethyl)urea(nitrosomethyl)ureaSCHEMBL306978RHGYANGWZZFRIJ-UHFFFAOYSA-N
Show more names
Urea, N-(nitrosomethyl)-
AKOS006340971DB-352584
Database identifiers
- CAS
36851-80-6- PubChem CID
- 104823
- DTXSID
DTXSID90190328- Nikkaji
- J325.147K
Properties
Computed structural properties
- XLogP
- -1.6
- Topological polar surface area
- 84.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 7
- Formal charge
- 0
- Complexity
- 81
Experimental & physicochemical properties
Chemical ClassesNitrogen Compounds -> Other Nitrogen Compounds
Physicochemical properties
- Boiling point
- 188 ℃ · 188℃
- Density
- 1.58 · 1.58
- Flash point
- 68 ℃ · 68℃
- pka
- 11.5 · 11.50±0.46(Predicted)
Safety & regulation
Hazard information
Hazards SummarySee NITROSAMINES.
Chemistry & industry
Upstream & downstream products
Downstream products
Suppliers4 total
梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]
sgtlifesciences pvt ltd+91-8790379245 · [email protected]
Alchem Pharmtech,Inc.8485655694 · [email protected]
重庆卡兰医药有限公司[email protected]
Related reactions
34 records
Compound notes
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