Basic information
- CAS
57164-98-4- Standard SMILES
COc1cc([N+](=O)[O-])ccc1NS(C)(=O)=O- InChIKey
OGHIXDRDSPVXJZ-UHFFFAOYSA-N- Molecular formula
- C8H10N2O5S
- Average molar mass
- 246.24 g/mol
- Monoisotopic mass
- 246.03104242
Names & identifiers
- Preferred name
- N-(2-methoxy-4-nitrophenyl)methanesulfonamide
- IUPAC
- N-(2-methoxy-4-nitrophenyl)methanesulfonamide
- English name
- N-(2-METHOXY-4-NITRO-PHENYL)-METHANESULFONAMIDE
- Molecular formula
- C8H10N2O5S
- Molecular weight
- 246.24
Names & synonyms
N-(2-methoxy-4-nitrophenyl)methanesulfonamide57164-98-4DTXSID20391189RefChem:360850DTXCID20342050CHEMBL3818832-methoxy-4-nitro-methanesulfonylaminobenzeneOprea1_608647SCHEMBL3247619OGHIXDRDSPVXJZ-UHFFFAOYSA-NBDBM50182534STL508687
Show more names
2'-METHOXY-4'-NITROMETHANESULFONANILIDE2'-METHOXY-4'-NITROMETHANESULFONANILIDEN-(2-METHOXY-4-NITRO-PHENYL)-METHANESULFONAMIDEMethanesulfonamide, N-(2-methoxy-4-nitrophenyl)-
AKOS003981158AKOS015965947CCG-356475SB80616ST50552859(2-methoxy-4-nitrophenyl)(methylsulfonyl)amine
Database identifiers
- CAS
57164-98-4- PubChem CID
- 3298129
- DTXSID
DTXSID20391189- ChEMBL
CHEMBL381883- EC Number
- 668-488-3
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 110 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 344
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 319 · H319
- Precautionary statements
- 264 · P264-P280-P305+P351+P338-P337+P313P
Safety & regulation
GHS classification
GHS Classification
Warning
H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
P264+P265, P280, P305+P351+P338, and P337+P317 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 1 notifications to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesEye Irrit. 2 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H319
- Precautionary statements
- P264-P280-P305+P351+P338-P337+P313P
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers1 total
Aromsyn Co., Ltd.+86-0571-85585865 +86-13336024896 · [email protected]
Related reactions
6 records
Compound notes
Loading…