Basic information
- CAS
943-41-9- Standard SMILES
CN(N=O)c1ccc([N+](=O)[O-])cc1- InChIKey
AMTRFSFECFPSHF-UHFFFAOYSA-N- Molecular formula
- C7H7N3O3
- Average molar mass
- 181.15 g/mol
- Monoisotopic mass
- 181.04874109
Names & identifiers
- Preferred name
- N-Methyl-4-nitro-N-nitrosobenzenamine
- IUPAC
- N-methyl-N-(4-nitrophenyl)nitrous amide
- English name
- N-nitroso-N-methyl-4-nitroaniline
- Molecular formula
- C7H7N3O3
- Molecular weight
- 181.15
Names & synonyms
N-Nitroso-N-methyl-4-nitroaniline943-41-9N-Methyl-4-nitro-N-nitrosobenzenamineN-Methyl-p-nitro-N-nitrosoanilineBenzenamine, N-methyl-4-nitro-N-nitroso-DTXSID4021002MMT2K8VW9VANILINE, N-METHYL-p-NITRO-N-NITROSO-NSC-528438DTXCID901002RefChem:927239NMNA
Show more names
RS RMA04361N-methyl-N-nitroso-4-nitroaniline1-METHYL-1-(4-NITROPHENYL)-2-OXOHYDRAZINE
N-methyl-4-nitro-N-nitrosoanilineN-methyl-N-(4-nitrophenyl)nitrous amideC7H7N3O3NSC 528438BRN 0912232NSC528438UNII-MMT2K8VW9VSCHEMBL8290211
Database identifiers
- CAS
943-41-9- PubChem CID
- 13671
- DTXSID
DTXSID4021002- ChEMBL
CHEMBL3186468- UNII
- MMT2K8VW9V
- EC Number
- 103-996-6
- Nikkaji
- J477.653D
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 78.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 196
Experimental & physicochemical properties
SpringerMaterials Properties15N nuclear magnetic resonance spectrum
Physicochemical properties
- Melting point
- 100 · 100-101 °C
- Boiling point
- 380.5 · 380.5±34.0 °C(Predicted)
- Density
- 1.35 · 1.35±0.1 g/cm3(Predicted)
- pka
- -6.12 · -6.12±0.50(Predicted)
- FDA UNII
- 2 K8VW9V · MMT2K8VW9V
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Upstream & downstream products
Downstream products
Suppliers5 total
湖北瑞玛标物科技有限公司15787879035 15787875101 · [email protected]
山东领海生物科技有限公司15092083467 · [email protected]
北京氪尔科技有限公司17710868586 · [email protected]
TLC梯尔希（南京）药物研发有限公司18012923235 18012923235 · [email protected]
Shaanxi Dideu Medichem Co. Ltd+86-17392712779 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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