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Home > Boronic Acids > 947162-87-0
947162-87-0 | 6-(hydroxymethyl)-1,3-dihydro-2,1-benzoxaborol-1-ol
CAS No: 947162-87-0 Catalog No: AG01B5RI MDL No:MFCD22572913
Product Description
Catalog Number:
AG01B5RI
Chemical Name:
6-(hydroxymethyl)-1,3-dihydro-2,1-benzoxaborol-1-ol
CAS Number:
947162-87-0
Molecular Formula:
C8H9BO3
Molecular Weight:
163.9663
MDL Number:
MFCD22572913
IUPAC Name:
(1-hydroxy-3H-2,1-benzoxaborol-6-yl)methanol
InChI:
InChI=1S/C8H9BO3/c10-4-6-1-2-7-5-12-9(11)8(7)3-6/h1-3,10-11H,4-5H2
InChI Key:
SESOJWCZJGQDCJ-UHFFFAOYSA-N
SMILES:
OCc1ccc2c(c1)B(O)OC2
Properties
Complexity:
164
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
164.064g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
163.967g/mol
Monoisotopic Mass:
164.064g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
49.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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