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1309982-29-3 | Boronic acid, B-[6-(cyclopropylamino)-2-pyridinyl]-
CAS No: 1309982-29-3 Catalog No: AG000V9U MDL No:MFCD09607789
Product Description
Catalog Number:
AG000V9U
Chemical Name:
Boronic acid, B-[6-(cyclopropylamino)-2-pyridinyl]-
CAS Number:
1309982-29-3
Molecular Formula:
C8H11BN2O2
Molecular Weight:
177.9961
MDL Number:
MFCD09607789
IUPAC Name:
[6-(cyclopropylamino)pyridin-2-yl]boronic acid
InChI:
InChI=1S/C8H11BN2O2/c12-9(13)7-2-1-3-8(11-7)10-6-4-5-6/h1-3,6,12-13H,4-5H2,(H,10,11)
InChI Key:
ZHNFDQJLAVSUQV-UHFFFAOYSA-N
SMILES:
OB(c1cccc(n1)NC1CC1)O
Properties
Complexity:
176
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
178.091g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
177.998g/mol
Monoisotopic Mass:
178.091g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
65.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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