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Home > Boronic Acids > 924279-82-3
924279-82-3 | (4-carbamoyl-3,5-difluorophenyl)boronic acid
CAS No: 924279-82-3 Catalog No: AG01DDYE MDL No:MFCD18447592
Product Description
Catalog Number:
AG01DDYE
Chemical Name:
(4-carbamoyl-3,5-difluorophenyl)boronic acid
CAS Number:
924279-82-3
Molecular Formula:
C7H6BF2NO3
Molecular Weight:
200.9352
MDL Number:
MFCD18447592
IUPAC Name:
(4-carbamoyl-3,5-difluorophenyl)boronic acid
InChI:
InChI=1S/C7H6BF2NO3/c9-4-1-3(8(13)14)2-5(10)6(4)7(11)12/h1-2,13-14H,(H2,11,12)
InChI Key:
UICFTLBHIJDLHI-UHFFFAOYSA-N
SMILES:
OB(c1cc(F)c(c(c1)F)C(=O)N)O
Properties
Complexity:
217
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
201.041g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
200.936g/mol
Monoisotopic Mass:
201.041g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
83.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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