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6-bromo-2-(5-methylthiophen-2-yl)quinoline-4-carboxylic acid

6-bromo-2-(5-methylthiophen-2-yl)quinoline-4-carboxylic acid

CAS: 350998-05-9

Formula: C15H10BrNO2S

SMILES: CC1=CC=C(S1)C1=CC(C(O)=O)=C2C=C(Br)C=CC2=N1

IUPAC: 6-bromo-2-(5-methylthiophen-2-yl)quinoline-4-carboxylic acid

InChI: InChI=1S/C15H10BrNO2S/c1-8-2-5-14(20-8)13-7-11(15(18)19)10-6-9(16)3-4-12(10)17-13/h2-7H,1H3,(H,18,19)

Composition: C (51.74%), H (2.89%), Br (22.95%), N (4.02%), O (9.19%), S (9.21%)

Molar Mass: 348.21

Atom Count: 30

Heavy Atom Count: 20

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 346.961563
Formal Charge 0
FSP3 0.07
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey CLZOZMVUPORLTR-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 81.57
Topological Polar Surface Area 50.19
Polarizability 33.34
Ring Count 3
Rotatable Bond Count 2

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Purity LeadTime CAS PacketSize UnitPrice
95% <2 Days 350998-05-9 $101.60$101.60
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