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nitrocyclobutane

nitrocyclobutane

CAS: 2625-41-4

Formula: C4H7NO2

SMILES: [O-][N+](=O)C1CCC1

IUPAC: nitrocyclobutane

InChI: InChI=1S/C4H7NO2/c6-5(7)4-2-1-3-4/h4H,1-3H2

Composition: C (47.52%), H (6.98%), N (13.85%), O (31.65%)

Molar Mass: 101.105

Atom Count: 14

Heavy Atom Count: 7

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 0
Exact Mass 101.047678469
Formal Charge 0
FSP3 1
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 0
InChIKey IPVBXZMWDWJWHR-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 23.4
Topological Polar Surface Area 43.14
Polarizability 9.35
Ring Count 1
Rotatable Bond Count 1

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