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3-chloro-N-(3-fluorophenyl)propanamide

3-chloro-N-(3-fluorophenyl)propanamide

CAS: 100638-26-4

Formula: C9H9ClFNO

SMILES: FC1=CC=CC(NC(=O)CCCl)=C1

IUPAC: 3-chloro-N-(3-fluorophenyl)propanamide

InChI: InChI=1S/C9H9ClFNO/c10-5-4-9(13)12-8-3-1-2-7(11)6-8/h1-3,6H,4-5H2,(H,12,13)

Composition: C (53.61%), H (4.50%), Cl (17.58%), F (9.42%), N (6.95%), O (7.94%)

Molar Mass: 201.63

Atom Count: 22

Heavy Atom Count: 13

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 201.0356698
Formal Charge 0
FSP3 0.22
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 1
InChIKey NXEZFWIYWQILFE-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 50.59
Topological Polar Surface Area 29.1
Polarizability 18.61
Ring Count 1
Rotatable Bond Count 3

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AA BLOCKS INC
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Purity LeadTime CAS PacketSize UnitPrice
95% <6 Days 100638-26-4 $65.55-$258.75$65.55$258.75
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ChemBridge Corp.
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95% <4 Days 100638-26-4 $58.65-$232.30$58.65$232.30
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