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4-chloro-2-methyl-3-propylquinoline-6-carboxylic acid

4-chloro-2-methyl-3-propylquinoline-6-carboxylic acid

CAS: 332150-03-5

Formula: C14H14ClNO2

SMILES: CCCC1=C(Cl)C2=CC(=CC=C2N=C1C)C(O)=O

IUPAC: 4-chloro-2-methyl-3-propylquinoline-6-carboxylic acid

InChI: InChI=1S/C14H14ClNO2/c1-3-4-10-8(2)16-12-6-5-9(14(17)18)7-11(12)13(10)15/h5-7H,3-4H2,1-2H3,(H,17,18)

Composition: C (63.76%), H (5.35%), Cl (13.44%), N (5.31%), O (12.13%)

Molar Mass: 263.72

Atom Count: 32

Heavy Atom Count: 18

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 263.0713064
Formal Charge 0
FSP3 0.29
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey RBHHKHINJXXXSY-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 70.87
Topological Polar Surface Area 50.19
Polarizability 28.35
Ring Count 2
Rotatable Bond Count 3

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Purity LeadTime CAS PacketSize UnitPrice
95% <4 Days 332150-03-5 $125.35-$234.60$125.35$234.60
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