Home Carboxys 2-(1-aminoethyl)-5-methyl-1,3-thiazole-4-carboxylic acid hydrochloride

2-(1-aminoethyl)-5-methyl-1,3-thiazole-4-carboxylic acid hydrochloride

CAS No.:
2138413-45-1
Catalog Number:
AG01ELL4
Molecular Formula:
C7H11ClN2O2S
Molecular Weight:
222.6924
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Product Description
Catalog Number:
AG01ELL4
Chemical Name:
2-(1-aminoethyl)-5-methyl-1,3-thiazole-4-carboxylic acid hydrochloride
CAS Number:
2138413-45-1
Molecular Formula:
C7H11ClN2O2S
Molecular Weight:
222.6924
MDL Number:
MFCD31453465
IUPAC Name:
2-(1-aminoethyl)-5-methyl-1,3-thiazole-4-carboxylic acid;hydrochloride
InChI:
InChI=1S/C7H10N2O2S.ClH/c1-3(8)6-9-5(7(10)11)4(2)12-6;/h3H,8H2,1-2H3,(H,10,11);1H
InChI Key:
HTNGAWIQTOVLMY-UHFFFAOYSA-N
SMILES:
CC(c1sc(c(n1)C(=O)O)C)N.Cl
Properties
Complexity:
188  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.023g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
222.687g/mol
Monoisotopic Mass:
222.023g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
104A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties