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1-[(2-chloro-1,3-thiazol-5-yl)methyl]piperidine-4-carboxylic acid hydrochloride

1-[(2-chloro-1,3-thiazol-5-yl)methyl]piperidine-4-carboxylic acid hydrochloride

CAS: 1052404-18-8

Formula: C10H14Cl2N2O2S

SMILES: Cl.OC(=O)C1CCN(CC2=CN=C(Cl)S2)CC1

IUPAC: 1-[(2-chloro-1,3-thiazol-5-yl)methyl]piperidine-4-carboxylic acid hydrochloride

InChI: InChI=1S/C10H13ClN2O2S.ClH/c11-10-12-5-8(16-10)6-13-3-1-7(2-4-13)9(14)15;/h5,7H,1-4,6H2,(H,14,15);1H

Composition: C (40.41%), H (4.75%), Cl (23.86%), N (9.43%), O (10.77%), S (10.79%)

Molar Mass: 297.19

Atom Count: 31

Heavy Atom Count: 17

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 296.0153043
Formal Charge 0
FSP3 0.6
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 1
InChIKey AMBHKPHXADDJRT-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 63
Topological Polar Surface Area 53.43
Polarizability 24.41
Ring Count 2
Rotatable Bond Count 3

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Purity LeadTime CAS PacketSize UnitPrice
90% <2 Days 1052404-18-8 $51.35-$524.40$51.35$63.37$86.31$524.40
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Key Organics Ltd
Supplier Profile
Purity LeadTime CAS PacketSize UnitPrice
90% <2 Days 1052404-18-8 $51.35-$524.40$51.35$63.37$86.31$524.40
Request Quote