Home Aminos 2-[2-amino-4-(thiophen-2-yl)-1,3-thiazol-5-yl]acetic acid hydrobromide

2-[2-amino-4-(thiophen-2-yl)-1,3-thiazol-5-yl]acetic acid hydrobromide

CAS No.:
1156039-71-2
Catalog Number:
AG019IPB
Molecular Formula:
C9H9BrN2O2S2
Molecular Weight:
321.2140
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Product Description
Catalog Number:
AG019IPB
Chemical Name:
2-[2-amino-4-(thiophen-2-yl)-1,3-thiazol-5-yl]acetic acid hydrobromide
CAS Number:
1156039-71-2
Molecular Formula:
C9H9BrN2O2S2
Molecular Weight:
321.2140
MDL Number:
MFCD08234359
IUPAC Name:
2-(2-amino-4-thiophen-2-yl-1,3-thiazol-5-yl)acetic acid;hydrobromide
InChI:
InChI=1S/C9H8N2O2S2.BrH/c10-9-11-8(5-2-1-3-14-5)6(15-9)4-7(12)13;/h1-3H,4H2,(H2,10,11)(H,12,13);1H
InChI Key:
JMEVEIZENHQCCN-UHFFFAOYSA-N
SMILES:
OC(=O)Cc1sc(nc1c1cccs1)N.Br
Properties
Complexity:
252  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
319.929g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
321.207g/mol
Monoisotopic Mass:
319.929g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
133A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties