Home Carboxys Ethyl 2-aminothiazole-4-carboxylate hydrobromide

Ethyl 2-aminothiazole-4-carboxylate hydrobromide

CAS No.:
127942-30-7
Catalog Number:
AG0039AE
Molecular Formula:
C6H9BrN2O2S
Molecular Weight:
253.1169
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Product Description
Catalog Number:
AG0039AE
Chemical Name:
Ethyl 2-aminothiazole-4-carboxylate hydrobromide
CAS Number:
127942-30-7
Molecular Formula:
C6H9BrN2O2S
Molecular Weight:
253.1169
MDL Number:
MFCD06653384
IUPAC Name:
ethyl 2-amino-1,3-thiazole-4-carboxylate;hydrobromide
InChI:
InChI=1S/C6H8N2O2S.BrH/c1-2-10-5(9)4-3-11-6(7)8-4;/h3H,2H2,1H3,(H2,7,8);1H
InChI Key:
KQLKNNNNKWTAMQ-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1csc(n1)N.Br
Properties
Complexity:
154  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
251.957g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
253.114g/mol
Monoisotopic Mass:
251.957g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
93.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties