Home Other Building Blocks 3-(2-METHYL-1,3-THIAZOL-5-YL)PROPANOIC ACID

3-(2-METHYL-1,3-THIAZOL-5-YL)PROPANOIC ACID

CAS No.:
60588-57-0
Catalog Number:
AG01DZRN
Molecular Formula:
C7H9NO2S
Molecular Weight:
171.2169
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Product Description
Catalog Number:
AG01DZRN
Chemical Name:
3-(2-METHYL-1,3-THIAZOL-5-YL)PROPANOIC ACID
CAS Number:
60588-57-0
Molecular Formula:
C7H9NO2S
Molecular Weight:
171.2169
MDL Number:
MFCD17267447
IUPAC Name:
3-(2-methyl-1,3-thiazol-5-yl)propanoic acid
InChI:
InChI=1S/C7H9NO2S/c1-5-8-4-6(11-5)2-3-7(9)10/h4H,2-3H2,1H3,(H,9,10)
InChI Key:
DXWAMOUMQYPGDC-UHFFFAOYSA-N
SMILES:
Cc1ncc(s1)CCC(=O)O
Properties
Complexity:
151  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
171.035g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
171.214g/mol
Monoisotopic Mass:
171.035g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
78.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Properties