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Home > Boronic Acids > 1150114-50-3
1150114-50-3 | Boronic acid, B-(6-propoxy-3-pyridinyl)-
CAS No: 1150114-50-3 Catalog No: AG000FMR MDL No:MFCD11855844
Product Description
Catalog Number:
AG000FMR
Chemical Name:
Boronic acid, B-(6-propoxy-3-pyridinyl)-
CAS Number:
1150114-50-3
Molecular Formula:
C8H12BNO3
Molecular Weight:
180.9968
MDL Number:
MFCD11855844
IUPAC Name:
(6-propoxypyridin-3-yl)boronic acid
InChI:
InChI=1S/C8H12BNO3/c1-2-5-13-8-4-3-7(6-10-8)9(11)12/h3-4,6,11-12H,2,5H2,1H3
InChI Key:
CJLTUVAWEWYGJU-UHFFFAOYSA-N
SMILES:
CCCOc1ccc(cn1)B(O)O
Properties
Complexity:
145
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
181.091g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
180.998g/mol
Monoisotopic Mass:
181.091g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
62.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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