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2088367-87-5

2088367-87-5 | 5-Carbamoyl-2-(trifluoromethoxy)phenylboronic acid

CAS No: 2088367-87-5 Catalog No: AG01EHO9 MDL No:MFCD19981514

Product Description

Catalog Number:
AG01EHO9
Chemical Name:
5-Carbamoyl-2-(trifluoromethoxy)phenylboronic acid
CAS Number:
2088367-87-5
MDL Number:
MFCD19981514
IUPAC Name:
[5-carbamoyl-2-(trifluoromethoxy)phenyl]boronic acid
InChI:
InChI=1S/C8H7BF3NO4/c10-8(11,12)17-6-2-1-4(7(13)14)3-5(6)9(15)16/h1-3,15-16H,(H2,13,14)
InChI Key:
PIVJPVFPITTYSD-UHFFFAOYSA-N

Properties

Complexity:
286  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
249.042g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
248.952g/mol
Monoisotopic Mass:
249.042g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
92.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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