Benzene, 1-nitro-4-(2-propenylsulfonyl)-
Basic information
- CAS
3729-43-9- Standard SMILES
C=CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1- InChIKey
ZPAQSZIDGBNTNX-UHFFFAOYSA-N- Molecular formula
- C9H9NO4S
- Average molar mass
- 227.24 g/mol
- Monoisotopic mass
- 227.02522894
Names & identifiers
- Preferred name
- Benzene, 1-nitro-4-(2-propenylsulfonyl)-
- IUPAC
- 1-nitro-4-prop-2-enylsulfonylbenzene
Names & synonyms
3729-43-9Benzene, 1-nitro-4-(2-propenylsulfonyl)-DTXSID30358445RefChem:323841DTXCID003095001-nitro-4-prop-2-enylsulfonylbenzene1-(allylsulfonyl)-4-nitrobenzene1-NITRO-4-(PROP-2-ENE-1-SULFONYL)BENZENESTK897529AKOS0036663691-nitro-4-(prop-2-en-1-ylsulfonyl)benzeneSR-01000254264
Show more names
SR-01000254264-1
Database identifiers
- CAS
3729-43-9- PubChem CID
- 895702
- DTXSID
DTXSID30358445- Nikkaji
- J747.653A
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 88.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 330
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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