Home Other Building Blocks 2,2-difluoro-2-(4-methyl-1,3-thiazol-2-yl)acetic acid

2,2-difluoro-2-(4-methyl-1,3-thiazol-2-yl)acetic acid

CAS No.:
1461714-21-5
Catalog Number:
AG01A3JF
Molecular Formula:
C6H5F2NO2S
Molecular Weight:
193.1712
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Product Description
Catalog Number:
AG01A3JF
Chemical Name:
2,2-difluoro-2-(4-methyl-1,3-thiazol-2-yl)acetic acid
CAS Number:
1461714-21-5
Molecular Formula:
C6H5F2NO2S
Molecular Weight:
193.1712
MDL Number:
MFCD25371568
IUPAC Name:
2,2-difluoro-2-(4-methyl-1,3-thiazol-2-yl)acetic acid
InChI:
InChI=1S/C6H5F2NO2S/c1-3-2-12-4(9-3)6(7,8)5(10)11/h2H,1H3,(H,10,11)
InChI Key:
GBCIRLJMVHDESE-UHFFFAOYSA-N
SMILES:
OC(=O)C(c1scc(n1)C)(F)F
Properties
Complexity:
200  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.001g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
193.168g/mol
Monoisotopic Mass:
193.001g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
78.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties