5-(2-Nitroethenyl)-1,3-benzodioxole
Properties
- Molecular formula
- C9H7NO4
- Molar mass
- 193.16 g/mol
- Exact mass
- 193.0375 Da
- Melting point
- 162–163 °C
- logP
- 1.66Crippen estimate
- Polar surface area
- 61.6 Ų
- H-bond donors / acceptors
- 0 / 4
- Rotatable bonds
- 2
Hazards
No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library
Identifiers
CAS number
1485-00-3SMILES
O=[N+]([O-])C=Cc1ccc2c(c1)OCO2InChIKey
KFLWBZPSJQPRDD-UHFFFAOYSA-NInChI
InChI=1S/C9H7NO4/c11-10(12)4-3-7-1-2-8-9(5-7)14-6-13-8/h1-5H,6H2Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
12 names
- 1,3-Benzodioxole, 5-(2-nitroethenyl)-
- Styrene, 3,4-(methylenedioxy)-β-nitro-
- 1-(2-Nitrovinyl)-3,4-methylenedioxybenzene
- 3,4-Methylenedioxy-1-(2-nitrovinyl)benzene
- 5-(2-Nitrovinyl)-1,3-benzodioxole
- 3,4-(Methylenedioxy)-β-nitrostyrene
- 5-(2-Nitrovinyl)benzodioxole
- NSC 10120
- NSC 105303
- NSC 170724
- MNS
- Syk inhibitor III
Work with 5-(2-Nitroethenyl)-1,3-benzodioxole
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Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds