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N-(1,3-benzothiazol-2-yl)-2-chloropropanamide

N-(1,3-benzothiazol-2-yl)-2-chloropropanamide

CAS: 26608-39-9

Formula: C10H9ClN2OS

SMILES: CC(Cl)C(=O)NC1=NC2=CC=CC=C2S1

IUPAC: N-(1,3-benzothiazol-2-yl)-2-chloropropanamide

InChI: InChI=1/C10H9ClN2OS/c1-6(11)9(14)13-10-12-7-4-2-3-5-8(7)15-10/h2-6H,1H3,(H,12,13,14)

Composition: C (49.90%), H (3.77%), Cl (14.73%), N (11.64%), O (6.65%), S (13.32%)

Molar Mass: 240.71

Atom Count: 24

Heavy Atom Count: 15

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 1
Exact Mass 240.0124118
Formal Charge 0
FSP3 0.2
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey PGMYTKVYVIGKNK-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 60.71
Topological Polar Surface Area 41.99
Polarizability 24.19
Ring Count 2
Rotatable Bond Count 2

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95% <6 Days 26608-39-9 $443.90-$469.20$443.90$469.20
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