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Home > Boronic Acids > 119673-41-5
119673-41-5 | 1,3,6,2-Benzodioxazaboronine, 4,5,6,7-tetrahydro-2-hydroxy-9-methyl-
CAS No: 119673-41-5 Catalog No: AG000PFK MDL No:
Product Description
Catalog Number:
AG000PFK
Chemical Name:
1,3,6,2-Benzodioxazaboronine, 4,5,6,7-tetrahydro-2-hydroxy-9-methyl-
CAS Number:
119673-41-5
Molecular Formula:
C10H14BNO3
Molecular Weight:
207.0341
IUPAC Name:
2-hydroxy-9-methyl-4,5,6,7-tetrahydro-1,3,6,2-benzodioxazaboronine
InChI:
InChI=1S/C10H14BNO3/c1-8-2-3-10-9(6-8)7-12-4-5-14-11(13)15-10/h2-3,6,12-13H,4-5,7H2,1H3
InChI Key:
YIIDGHPDDPSMSB-UHFFFAOYSA-N
SMILES:
OB1OCCNCc2c(O1)ccc(c2)C
Properties
Complexity:
205
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.107g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
207.036g/mol
Monoisotopic Mass:
207.107g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
50.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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