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Home Halogens 4-(chloromethyl)-2-(1-methyl-1H-pyrazol-4-yl)-1,3-thiazole hydrochloride

4-(chloromethyl)-2-(1-methyl-1H-pyrazol-4-yl)-1,3-thiazole hydrochloride

CAS No.:
1171519-22-4
Catalog Number:
AG019V9F
Molecular Formula:
C8H9Cl2N3S
Molecular Weight:
250.1482
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Product Description
Catalog Number:
AG019V9F
Chemical Name:
4-(chloromethyl)-2-(1-methyl-1H-pyrazol-4-yl)-1,3-thiazole hydrochloride
CAS Number:
1171519-22-4
Molecular Formula:
C8H9Cl2N3S
Molecular Weight:
250.1482
MDL Number:
MFCD12197079
IUPAC Name:
4-(chloromethyl)-2-(1-methylpyrazol-4-yl)-1,3-thiazole;hydrochloride
InChI:
InChI=1S/C8H8ClN3S.ClH/c1-12-4-6(3-10-12)8-11-7(2-9)5-13-8;/h3-5H,2H2,1H3;1H
InChI Key:
HNFUAJWZSJIATE-UHFFFAOYSA-N
SMILES:
ClCc1csc(n1)c1cnn(c1)C.Cl
Properties
Complexity:
181  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
248.989g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
250.141g/mol
Monoisotopic Mass:
248.989g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
59A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties