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Home > Boronic Acids > 1187209-16-0
1187209-16-0 | 4-Borono-2-isobutylbenzoic acid
CAS No: 1187209-16-0 Catalog No: AG00HEPT MDL No:
Product Description
Catalog Number:
AG00HEPT
Chemical Name:
4-Borono-2-isobutylbenzoic acid
CAS Number:
1187209-16-0
IUPAC Name:
4-borono-2-(2-methylpropyl)benzoic acid
InChI:
InChI=1S/C11H15BO4/c1-7(2)5-8-6-9(12(15)16)3-4-10(8)11(13)14/h3-4,6-7,15-16H,5H2,1-2H3,(H,13,14)
InChI Key:
FXXIOHKSGZLJFH-UHFFFAOYSA-N
Properties
Complexity:
242
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.106g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
222.047g/mol
Monoisotopic Mass:
222.106g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
77.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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