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2-(chloromethyl)-1,3-thiazole hydrochloride

2-(chloromethyl)-1,3-thiazole hydrochloride

CAS: 71670-79-6

Formula: C4H5Cl2NS

SMILES: Cl.ClCC1=NC=CS1

IUPAC: 2-(chloromethyl)-1,3-thiazole hydrochloride

InChI: InChI=1S/C4H4ClNS.ClH/c5-3-4-6-1-2-7-4;/h1-2H,3H2;1H

Composition: C (28.25%), H (2.96%), Cl (41.69%), N (8.24%), S (18.85%)

Molar Mass: 170.05

Atom Count: 13

Heavy Atom Count: 8

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 168.9519757
Formal Charge 0
FSP3 0.25
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 0
InChIKey ICKMSJLWRQTIFI-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 30.46
Topological Polar Surface Area 12.89
Polarizability 11.85
Ring Count 1
Rotatable Bond Count 1

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Purity (%)
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ChemBridge Corp.
Purity LeadTime CAS PacketSize UnitPrice
95% <4 Days 71670-79-6 $152.95-$1,933.15$152.95$379.50$1,933.15
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