Basic information
- CAS
262357-37-9- Standard SMILES
CNC(=O)c1ccc(Cl)c([N+](=O)[O-])c1- InChIKey
AYMSQYWHOFXMCF-UHFFFAOYSA-N- Molecular formula
- C8H7ClN2O3
- Average molar mass
- 214.6 g/mol
- Monoisotopic mass
- 214.0145198
Names & identifiers
- Preferred name
- 4-chloro-N-methyl-3-nitrobenzamide
- IUPAC
- 4-chloro-N-methyl-3-nitrobenzamide
- English name
- 4-chloro-N-methyl-3-nitrobenzamide
- Molecular formula
- C8H7ClN2O3
- Molecular weight
- 214.61
Names & synonyms
4-chloro-N-methyl-3-nitrobenzamide262357-37-9DTXSID40355400RefChem:292072DTXCID70306460Benzamide, 4-chloro-N-methyl-3-nitro-Oprea1_276789Oprea1_518683SCHEMBL7973732AYMSQYWHOFXMCF-UHFFFAOYSA-N4-chloro-3-nitro-N-methylbenzamideMFCD01182365
Show more names
4-Chloro-N-methyl-3-nitrobenzamideQ: What is 4-Chloro-N-methyl-3-nitrobenzamide Q: What is the CAS Number of 4-Chloro-N-methyl-3-nitrobenzamide
STK097807AKOS000150071DB-332279ST45149419(4-chloro-3-nitrophenyl)-N-methylcarboxamideAG-690/11632130SR-01000355851SR-01000355851-1
Database identifiers
- CAS
262357-37-9- PubChem CID
- 799286
- DTXSID
DTXSID40355400
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 74.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 241
Physicochemical properties
- Boiling point
- 358.3 · 358.3±32.0 °C(Predicted)
- Density
- 1.397 · 1.397±0.06 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C
- pka
- 13.3 · 13.30±0.46(Predicted)
Chemistry & industry
Upstream & downstream products
Downstream products
Suppliers3 total
大连金点生物科技有限公司0411-0411-00000000 13644282108 · [email protected]
常州千艾生物科技有限公司051915240519135 13961152745 · [email protected]
Alchem Pharmtech,Inc.8485655694 · [email protected]
Related reactions
3 records
Compound notes
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