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Home > Boronic Acids > 1586045-56-8
1586045-56-8 | 5-Cyclopropyl-2-fluorophenylboronic acid
CAS No: 1586045-56-8 Catalog No: AG00HYHZ MDL No:MFCD21099634
Product Description
Catalog Number:
AG00HYHZ
Chemical Name:
5-Cyclopropyl-2-fluorophenylboronic acid
CAS Number:
1586045-56-8
Molecular Formula:
C9H10BFO2
Molecular Weight:
179.9839
MDL Number:
MFCD21099634
IUPAC Name:
(5-cyclopropyl-2-fluorophenyl)boronic acid
InChI:
InChI=1S/C9H10BFO2/c11-9-4-3-7(6-1-2-6)5-8(9)10(12)13/h3-6,12-13H,1-2H2
InChI Key:
PSCZYVJGVXSRIY-UHFFFAOYSA-N
SMILES:
OB(c1cc(ccc1F)C1CC1)O
Properties
Complexity:
185
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
180.076g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
179.985g/mol
Monoisotopic Mass:
180.076g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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