1-methyl-5-nitro-2,3-dihydroindole

1-methyl-5-nitro-2,3-dihydroindole

CAS: 18711-25-6

Formula: C9H10N2O2

SMILES: CN1CCC2=C1C=CC(=C2)[N+]([O-])=O

IUPAC: 1-methyl-5-nitro-2,3-dihydro-1H-indole

InChI: InChI=1S/C9H10N2O2/c1-10-5-4-7-6-8(11(12)13)2-3-9(7)10/h2-3,6H,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	0
InChIKey	VNTWOKSFYDNPED-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	50.12
Topological Polar Surface Area	46.38
Polarizability	18.06
Ring Count	2
Rotatable Bond Count	1

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Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<7 Days	18711-25-6		$194.48-$997.65$194.48$374.00$997.65