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1243174-57-3 | 1,3,2-Dioxaborolane-2-methanamine, 4,4,5,5-tetramethyl-α-(2-methylpropyl)-, hydrochloride (1:1), (αR)-
CAS No: 1243174-57-3 Catalog No: AG000LUE MDL No:MFCD26403994
Product Description
Catalog Number:
AG000LUE
Chemical Name:
1,3,2-Dioxaborolane-2-methanamine, 4,4,5,5-tetramethyl-α-(2-methylpropyl)-, hydrochloride (1:1), (αR)-
CAS Number:
1243174-57-3
Molecular Formula:
C11H25BClNO2
Molecular Weight:
249.5857
MDL Number:
MFCD26403994
IUPAC Name:
(1R)-3-methyl-1-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)butan-1-amine;hydrochloride
InChI:
InChI=1S/C11H24BNO2.ClH/c1-8(2)7-9(13)12-14-10(3,4)11(5,6)15-12;/h8-9H,7,13H2,1-6H3;1H/t9-;/m0./s1
InChI Key:
ADICRSVFBDCOLO-FVGYRXGTSA-N
SMILES:
CC(C[C@@H](B1OC(C(O1)(C)C)(C)C)N)C.Cl
Properties
Complexity:
213
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
249.167g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
249.586g/mol
Monoisotopic Mass:
249.167g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
44.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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