C1OC2=C(O1)C=C(C=C2)C=C[N+](=O)[O-]
Nombre: 5-(2-nitroethenyl)-1,3-benzodioxole
SMILES: C1OC2=C(O1)C=C(C=C2)C=C[N+](=O)[O-]

Molecular Processing

Molecular formula
C9H7NO4
Molecular weight
193.16
Exact mass
193.0375
XLogP
1.66
TPSA
61.6
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
14
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.111
Molar refractivity
48.59

Supplementary Information

InChIKey: KFLWBZPSJQPRDD-UHFFFAOYSA-N
Sinónimos
5-(2-nitroethenyl)-1,3-benzodioxoleDTXSID401017137RefChem:529614DTXCID2014754705-(2-nitroethenyl)-2H-1,3-benzodioxole5-(2-nitrovinyl)-1,3-benzodioxoleMFCD000145755-(2-Nitro-vinyl)-benzo[1,3]dioxolePiperonyliden-NitromethanMaybridge1_006736SCHEMBL744717KFLWBZPSJQPRDD-UHFFFAOYSA-NHMS3652B14XAA56848AKOS028108305SY464915DB-0142203,4-Methylenedioxy-1-(2-nitroethenyl)-benzeneF358436
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