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Home > Boronic Acids > 1350836-07-5
1350836-07-5 | (5-fluoro-1H-indol-4-yl)boronicacid
CAS No: 1350836-07-5 Catalog No: AG00IKS4 MDL No:
Product Description
Catalog Number:
AG00IKS4
Chemical Name:
(5-fluoro-1H-indol-4-yl)boronicacid
CAS Number:
1350836-07-5
Molecular Formula:
C8H7BFNO2
Molecular Weight:
178.9561
IUPAC Name:
(5-fluoro-1H-indol-4-yl)boronic acid
InChI:
InChI=1S/C8H7BFNO2/c10-6-1-2-7-5(3-4-11-7)8(6)9(12)13/h1-4,11-13H
InChI Key:
BGPHECXPHNAJCF-UHFFFAOYSA-N
SMILES:
OB(c1c(F)ccc2c1cc[nH]2)O
Properties
Complexity:
193
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
179.055g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
178.957g/mol
Monoisotopic Mass:
179.055g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
56.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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