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Home > Boronic Acids > 676273-51-1
676273-51-1 | 3-cyano-1H-indol-5-ylboronic acid
CAS No: 676273-51-1 Catalog No: AG00G1NA MDL No:
Product Description
Catalog Number:
AG00G1NA
Chemical Name:
3-cyano-1H-indol-5-ylboronic acid
CAS Number:
676273-51-1
IUPAC Name:
(3-cyano-1H-indol-5-yl)boronic acid
InChI:
InChI=1S/C9H7BN2O2/c11-4-6-5-12-9-2-1-7(10(13)14)3-8(6)9/h1-3,5,12-14H
InChI Key:
IRYMHSHEGNSRJM-UHFFFAOYSA-N
Properties
Complexity:
263
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
186.06g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
185.977g/mol
Monoisotopic Mass:
186.06g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
80A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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