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Home > Boronic Acids > 357274-85-2
357274-85-2 | ALPHA-(TRIFLUOROMETHYL)ETHENYL BORONIC ACID
CAS No: 357274-85-2 Catalog No: AG00C107 MDL No:MFCD03452762
Product Description
Catalog Number:
AG00C107
Chemical Name:
ALPHA-(TRIFLUOROMETHYL)ETHENYL BORONIC ACID
CAS Number:
357274-85-2
Molecular Formula:
C3H4BF3O2
Molecular Weight:
139.8689
MDL Number:
MFCD03452762
IUPAC Name:
3,3,3-trifluoroprop-1-en-2-ylboronic acid
InChI:
InChI=1S/C3H4BF3O2/c1-2(4(8)9)3(5,6)7/h8-9H,1H2
InChI Key:
POVDLRLOSUDCMI-UHFFFAOYSA-N
SMILES:
OB(C(=C)C(F)(F)F)O
Properties
Complexity:
119
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
140.026g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
139.868g/mol
Monoisotopic Mass:
140.026g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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