Home Other Building Blocks 2,2-difluoro-2-(1-methyl-6-oxo-1,6-dihydropyridin-3-yl)acetic acid

2,2-difluoro-2-(1-methyl-6-oxo-1,6-dihydropyridin-3-yl)acetic acid

CAS No.:
1860877-05-9
Catalog Number:
AG01EKXN
Molecular Formula:
C8H7F2NO3
Molecular Weight:
203.1429
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Product Description
Catalog Number:
AG01EKXN
Chemical Name:
2,2-difluoro-2-(1-methyl-6-oxo-1,6-dihydropyridin-3-yl)acetic acid
CAS Number:
1860877-05-9
Molecular Formula:
C8H7F2NO3
Molecular Weight:
203.1429
MDL Number:
MFCD31616145
IUPAC Name:
2,2-difluoro-2-(1-methyl-6-oxopyridin-3-yl)acetic acid
InChI:
InChI=1S/C8H7F2NO3/c1-11-4-5(2-3-6(11)12)8(9,10)7(13)14/h2-4H,1H3,(H,13,14)
InChI Key:
VWYWTRKNSBHFEL-UHFFFAOYSA-N
SMILES:
OC(=O)C(c1ccc(=O)n(c1)C)(F)F
Properties
Complexity:
347  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
203.039g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
203.145g/mol
Monoisotopic Mass:
203.039g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
57.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1  
Properties