5-nitro-1,3-dihydro-2-benzofuran

5-nitro-1,3-dihydro-2-benzofuran

CAS: 52771-99-0

Formula: C8H7NO3

SMILES: [O-][N+](=O)C1=CC=C2COCC2=C1

IUPAC: 5-nitro-1,3-dihydro-2-benzofuran

InChI: InChI=1S/C8H7NO3/c10-9(11)8-2-1-6-4-12-5-7(6)3-8/h1-3H,4-5H2

Composition: C (58.18%), H (4.27%), N (8.48%), O (29.06%)

Molar Mass: 165.148

Atom Count: 19

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	165.042593089
Formal Charge	0
FSP3	0.25
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	VZIBAMYIHSHADC-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	42.5
Topological Polar Surface Area	52.37
Polarizability	15.87
Ring Count	2
Rotatable Bond Count	1

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