Basic information
- CAS
13142-74-0- Standard SMILES
Cc1ccc(NC(N)=O)c([N+](=O)[O-])c1- InChIKey
SIJVYJRLCZOLCS-UHFFFAOYSA-N- Molecular formula
- C8H9N3O3
- Average molar mass
- 195.18 g/mol
- Monoisotopic mass
- 195.06439116
Names & identifiers
- Preferred name
- (4-Methyl-2-nitrophenyl)urea
- IUPAC
- (4-methyl-2-nitrophenyl)urea
- English name
- (4-methyl-2-nitrophenyl)urea
- Molecular formula
- C8H9N3O3
- Molecular weight
- 195.17536
Names & synonyms
(4-Methyl-2-nitrophenyl)urea13142-74-01-(4-methyl-2-nitrophenyl)ureaEINECS 236-079-5N-(4-Methyl-2-nitrophenyl)urea3-nitro-4-ureidotolueneSCHEMBL5523947DTXSID30157036SIJVYJRLCZOLCS-UHFFFAOYSA-NSTL071480AKOS005652153NS00024163
Show more names
Urea, N-(4-methyl-2-nitrophenyl)-
Database identifiers
- CAS
13142-74-0- PubChem CID
- 83176
- DTXSID
DTXSID30157036- EC Number
- 236-079-5
- Nikkaji
- J317.830G
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 101 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 238
Chemistry & industry
Suppliers1 total
陕西缔都医药化工有限公司029-81024372 17792795018 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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