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1225283-27-1 | 4,5-difluoro-1H-1,3-benzodiazole-2-carboxylic acid
CAS No: 1225283-27-1 Catalog No: AG01FL9Q MDL No:
Product Description
Catalog Number:
AG01FL9Q
Chemical Name:
4,5-difluoro-1H-1,3-benzodiazole-2-carboxylic acid
CAS Number:
1225283-27-1
IUPAC Name:
4,5-difluoro-1H-benzimidazole-2-carboxylic acid
InChI:
InChI=1S/C8H4F2N2O2/c9-3-1-2-4-6(5(3)10)12-7(11-4)8(13)14/h1-2H,(H,11,12)(H,13,14)
InChI Key:
FTXWRSYPIUTFNF-UHFFFAOYSA-N
Properties
Complexity:
252
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
198.024g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
198.129g/mol
Monoisotopic Mass:
198.024g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
66A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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