6-nitro-1H-indole-3-carbaldehyde

6-nitro-1H-indole-3-carbaldehyde

CAS: 10553-13-6

Formula: C9H6N2O3

SMILES: [O-][N+](=O)C1=CC=C2C(NC=C2C=O)=C1

IUPAC: 6-nitro-1H-indole-3-carbaldehyde

InChI: InChI=1S/C9H6N2O3/c12-5-6-4-10-9-3-7(11(13)14)1-2-8(6)9/h1-5,10H

Composition: C (56.85%), H (3.18%), N (14.73%), O (25.24%)

Molar Mass: 190.158

Atom Count: 20

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	190.037842061
Formal Charge	0
FSP3	0
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	KYFZSGBVGJNEPN-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	50.05
Topological Polar Surface Area	76
Polarizability	19.3
Ring Count	2
Rotatable Bond Count	2

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