methyl 4-nitro-2,3-dihydro-1H-indene-2-carboxylate

methyl 4-nitro-2,3-dihydro-1H-indene-2-carboxylate

CAS: 888327-27-3

Formula: C11H11NO4

SMILES: COC(=O)C1CC2=CC=CC(=C2C1)[N+]([O-])=O

IUPAC: methyl 4-nitro-2,3-dihydro-1H-indene-2-carboxylate

InChI: InChI=1/C11H11NO4/c1-16-11(13)8-5-7-3-2-4-10(12(14)15)9(7)6-8/h2-4,8H,5-6H2,1H3

Composition: C (59.73%), H (5.01%), N (6.33%), O (28.93%)

Molar Mass: 221.212

Atom Count: 27

Heavy Atom Count: 16

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	1
Exact Mass	221.068807838
Formal Charge	0
FSP3	0.36
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	KRHARWFTTQYZPM-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	56.27
Topological Polar Surface Area	69.44
Polarizability	21.49
Ring Count	2
Rotatable Bond Count	3

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Shanghai AQ BioPharma Co., Ltd.

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Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<8 Days	888327-27-3		$291.43-$4,196.57$291.43$874.29$1,398.86$2,622.86$4,196.57