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Home > Boronic Acids > 1236191-14-2
1236191-14-2 | Boronic acid, B-[3-(2,2-dimethylpropoxy)phenyl]-
CAS No: 1236191-14-2 Catalog No: AG000KV7 MDL No:MFCD18087686
Product Description
Catalog Number:
AG000KV7
Chemical Name:
Boronic acid, B-[3-(2,2-dimethylpropoxy)phenyl]-
CAS Number:
1236191-14-2
Molecular Formula:
C11H17BO3
Molecular Weight:
208.0619
MDL Number:
MFCD18087686
IUPAC Name:
[3-(2,2-dimethylpropoxy)phenyl]boronic acid
InChI:
InChI=1S/C11H17BO3/c1-11(2,3)8-15-10-6-4-5-9(7-10)12(13)14/h4-7,13-14H,8H2,1-3H3
InChI Key:
RMCIUKKXWNLWSX-UHFFFAOYSA-N
SMILES:
OB(c1cccc(c1)OCC(C)(C)C)O
Properties
Complexity:
189
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.127g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
208.064g/mol
Monoisotopic Mass:
208.127g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
49.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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