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

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

CAS No.:
1803570-24-2
Catalog Number:
AG01BDU5
Molecular Formula:
C5H3F2NO2S
Molecular Weight:
179.1446
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Product Description
Catalog Number:
AG01BDU5
Chemical Name:
2,2-difluoro-2-(1,3-thiazol-2-yl)acetic acid
CAS Number:
1803570-24-2
Molecular Formula:
C5H3F2NO2S
Molecular Weight:
179.1446
MDL Number:
MFCD28063912
IUPAC Name:
2,2-difluoro-2-(1,3-thiazol-2-yl)acetic acid
InChI:
InChI=1S/C5H3F2NO2S/c6-5(7,4(9)10)3-8-1-2-11-3/h1-2H,(H,9,10)
InChI Key:
VRUGPSWWDUJJGH-UHFFFAOYSA-N
SMILES:
OC(=O)C(c1nccs1)(F)F
Properties
Complexity:
176  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
178.985g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
179.141g/mol
Monoisotopic Mass:
178.985g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
78.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties