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2-benzoyl-5-chloro-1H-pyrrole

2-benzoyl-5-chloro-1H-pyrrole

CAS: 142231-06-9

Formula: C11H8ClNO

SMILES: ClC1=CC=C(N1)C(=O)C1=CC=CC=C1

IUPAC: 2-benzoyl-5-chloro-1H-pyrrole

InChI: InChI=1S/C11H8ClNO/c12-10-7-6-9(13-10)11(14)8-4-2-1-3-5-8/h1-7,13H

Composition: C (64.25%), H (3.92%), Cl (17.24%), N (6.81%), O (7.78%)

Molar Mass: 205.64

Atom Count: 22

Heavy Atom Count: 14

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 205.0294416
Formal Charge 0
FSP3 0
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 1
InChIKey PKOYUCYDNKHXNN-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 56.08
Topological Polar Surface Area 32.86
Polarizability 21.57
Ring Count 2
Rotatable Bond Count 2

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95% <5 Days 142231-06-9 $2,050.00-$4,660.00$2,050.00$3,360.00$4,660.00
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