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Home > Boronic Acids > 628692-16-0
628692-16-0 | (2-METHYLQUINOLIN-5-YL)BORONIC ACID
CAS No: 628692-16-0 Catalog No: AG00E9ZM MDL No:MFCD13193791
Product Description
Catalog Number:
AG00E9ZM
Chemical Name:
(2-METHYLQUINOLIN-5-YL)BORONIC ACID
CAS Number:
628692-16-0
Molecular Formula:
C10H10BNO2
Molecular Weight:
187.0029
MDL Number:
MFCD13193791
IUPAC Name:
(2-methylquinolin-5-yl)boronic acid
InChI:
InChI=1S/C10H10BNO2/c1-7-5-6-8-9(11(13)14)3-2-4-10(8)12-7/h2-6,13-14H,1H3
InChI Key:
AYBXNRMOAXIQMU-UHFFFAOYSA-N
SMILES:
Cc1ccc2c(n1)cccc2B(O)O
Properties
Complexity:
201
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
187.08g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
187.005g/mol
Monoisotopic Mass:
187.08g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
53.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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