4-methyl-7-nitro-2,3-dihydro-1H-indole

4-methyl-7-nitro-2,3-dihydro-1H-indole

CAS: 179176-31-9

Formula: C9H10N2O2

SMILES: CC1=CC=C(C2=C1CCN2)[N+]([O-])=O

IUPAC: 4-methyl-7-nitro-2,3-dihydro-1H-indole

InChI: InChI=1S/C9H10N2O2/c1-6-2-3-8(11(12)13)9-7(6)4-5-10-9/h2-3,10H,4-5H2,1H3

Composition: C (60.66%), H (5.66%), N (15.72%), O (17.96%)

Molar Mass: 178.191

Atom Count: 23

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	178.07422757
Formal Charge	0
FSP3	0.33
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	SCFZFJRSCMUKHY-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	50.92
Topological Polar Surface Area	55.17
Polarizability	17.99
Ring Count	2
Rotatable Bond Count	1

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