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Home > Boronic Acids > 844501-00-4
844501-00-4 | (1-(tert-Butoxycarbonyl);-1,2,3,6-tetrahydropyridin-4-yl);boronic acid
CAS No: 844501-00-4 Catalog No: AG004SFV MDL No:MFCD09997795
Product Description
Catalog Number:
AG004SFV
Chemical Name:
(1-(tert-Butoxycarbonyl);-1,2,3,6-tetrahydropyridin-4-yl);boronic acid
CAS Number:
844501-00-4
Molecular Formula:
C10H18BNO4
Molecular Weight:
227.0652
MDL Number:
MFCD09997795
IUPAC Name:
[1-[(2-methylpropan-2-yl)oxycarbonyl]-3,6-dihydro-2H-pyridin-4-yl]boronic acid
InChI:
InChI=1S/C10H18BNO4/c1-10(2,3)16-9(13)12-6-4-8(5-7-12)11(14)15/h4,14-15H,5-7H2,1-3H3
InChI Key:
WHYUAGZAHLUISP-UHFFFAOYSA-N
SMILES:
O=C(N1CCC(=CC1)B(O)O)OC(C)(C)C
Properties
Complexity:
296
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.133g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
227.067g/mol
Monoisotopic Mass:
227.133g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
70A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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