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Home > Boronic Acids > 1104637-40-2
1104637-40-2 | Methylboronic acid MIDA ester
CAS No: 1104637-40-2 Catalog No: AG003S3H MDL No:
Product Description
Catalog Number:
AG003S3H
Chemical Name:
Methylboronic acid MIDA ester
CAS Number:
1104637-40-2
IUPAC Name:
2,6-dimethyl-1,3,6,2-dioxazaborocane-4,8-dione
InChI:
InChI=1S/C6H10BNO4/c1-7-11-5(9)3-8(2)4-6(10)12-7/h3-4H2,1-2H3
InChI Key:
VXMLSGMSTPGVIA-UHFFFAOYSA-N
Properties
Complexity:
188
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
171.07g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
170.959g/mol
Monoisotopic Mass:
171.07g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
55.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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