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N-(3-chloro-4-methylphenyl)-1,3-benzothiazol-2-amine

N-(3-chloro-4-methylphenyl)-1,3-benzothiazol-2-amine

Formula: C14H11ClN2S

SMILES: CC1=C(Cl)C=C(NC2=NC3=CC=CC=C3S2)C=C1

IUPAC: N-(3-chloro-4-methylphenyl)-1,3-benzothiazol-2-amine

InChI: InChI=1S/C14H11ClN2S/c1-9-6-7-10(8-11(9)15)16-14-17-12-4-2-3-5-13(12)18-14/h2-8H,1H3,(H,16,17)

Composition: C (61.20%), H (4.04%), Cl (12.90%), N (10.20%), S (11.67%)

Molar Mass: 274.77

Atom Count: 29

Heavy Atom Count: 18

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 274.0331472
Formal Charge 0
FSP3 0.07
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey KOKNHIGKSUUWCU-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 74.93
Topological Polar Surface Area 24.92
Polarizability 29.97
Ring Count 3
Rotatable Bond Count 2

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Struchem co.,ltd
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Purity LeadTime Formula PacketSize UnitPrice
95% <5 Days C14H11ClN2S $1,540.00-$2,420.00$1,540.00$1,920.00$2,420.00
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