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2131006-93-2 |
CAS No: 2131006-93-2 Catalog No: AG01FLY4 MDL No:
Product Description
Catalog Number:
AG01FLY4
CAS Number:
2131006-93-2
IUPAC Name:
(4-methyl-5-nitropyridin-3-yl)boronic acid
InChI:
InChI=1S/C6H7BN2O4/c1-4-5(7(10)11)2-8-3-6(4)9(12)13/h2-3,10-11H,1H3
InChI Key:
QMDDCTIHENZTKS-UHFFFAOYSA-N
Properties
Complexity:
196
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
182.05g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
181.942g/mol
Monoisotopic Mass:
182.05g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
99.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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