1-(4-chloro-3-nitrobenzoyl)pyrrolidine

1-(4-chloro-3-nitrobenzoyl)pyrrolidine

CAS: 288154-78-9

Formula: C11H11ClN2O3

SMILES: [O-][N+](=O)C1=CC(=CC=C1Cl)C(=O)N1CCCC1

IUPAC: 1-(4-chloro-3-nitrobenzoyl)pyrrolidine

InChI: InChI=1S/C11H11ClN2O3/c12-9-4-3-8(7-10(9)14(16)17)11(15)13-5-1-2-6-13/h3-4,7H,1-2,5-6H2

Composition: C (51.88%), H (4.35%), Cl (13.92%), N (11.00%), O (18.85%)

Molar Mass: 254.67

Atom Count: 28

Heavy Atom Count: 17

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	254.0458199
Formal Charge	0
FSP3	0.36
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	WDBLKANQIMBLDU-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	63.6
Topological Polar Surface Area	63.45
Polarizability	23.68
Ring Count	2
Rotatable Bond Count	2

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