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Home > Boronic Acids > 1257648-75-1
1257648-75-1 | Boronic acid, B-[2-(1-pyrrolidinyl)-3-pyridinyl]-
CAS No: 1257648-75-1 Catalog No: AG000ONP MDL No:MFCD11867875
Product Description
Catalog Number:
AG000ONP
Chemical Name:
Boronic acid, B-[2-(1-pyrrolidinyl)-3-pyridinyl]-
CAS Number:
1257648-75-1
Molecular Formula:
C9H13BN2O2
Molecular Weight:
192.0227
MDL Number:
MFCD11867875
IUPAC Name:
(2-pyrrolidin-1-ylpyridin-3-yl)boronic acid
InChI:
InChI=1S/C9H13BN2O2/c13-10(14)8-4-3-5-11-9(8)12-6-1-2-7-12/h3-5,13-14H,1-2,6-7H2
InChI Key:
ROELQLBROWVGFW-UHFFFAOYSA-N
SMILES:
OB(c1cccnc1N1CCCC1)O
Properties
Complexity:
186
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.107g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
192.025g/mol
Monoisotopic Mass:
192.107g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
56.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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