Home Nitriles 2-(aminomethyl)-1,3-thiazole-4-carbonitrile hydrochloride

2-(aminomethyl)-1,3-thiazole-4-carbonitrile hydrochloride

CAS No.:
280781-74-0
Catalog Number:
AG01EJR4
Molecular Formula:
C5H6ClN3S
Molecular Weight:
175.6392
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Product Description
Catalog Number:
AG01EJR4
Chemical Name:
2-(aminomethyl)-1,3-thiazole-4-carbonitrile hydrochloride
CAS Number:
280781-74-0
Molecular Formula:
C5H6ClN3S
Molecular Weight:
175.6392
MDL Number:
MFCD30493645
IUPAC Name:
2-(aminomethyl)-1,3-thiazole-4-carbonitrile;hydrochloride
InChI:
InChI=1S/C5H5N3S.ClH/c6-1-4-3-9-5(2-7)8-4;/h3H,2,7H2;1H
InChI Key:
GADKCBBWERTBNI-UHFFFAOYSA-N
SMILES:
NCc1scc(n1)C#N.Cl
Properties
Complexity:
138  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
174.997g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
175.634g/mol
Monoisotopic Mass:
174.997g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
90.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties