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Home > Boronic Acids > 560132-24-3
560132-24-3 | M-T-BUTYLPHENYLBORONIC ACID
CAS No: 560132-24-3 Catalog No: AG00D9PE MDL No:MFCD11110647
Product Description
Catalog Number:
AG00D9PE
Chemical Name:
M-T-BUTYLPHENYLBORONIC ACID
CAS Number:
560132-24-3
Molecular Formula:
C10H15BO2
Molecular Weight:
178.0359
MDL Number:
MFCD11110647
IUPAC Name:
(3-tert-butylphenyl)boronic acid
InChI:
InChI=1S/C10H15BO2/c1-10(2,3)8-5-4-6-9(7-8)11(12)13/h4-7,12-13H,1-3H3
InChI Key:
OKBOGYOXEDEGOG-UHFFFAOYSA-N
SMILES:
OB(c1cccc(c1)C(C)(C)C)O
Properties
Complexity:
163
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
178.117g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
178.038g/mol
Monoisotopic Mass:
178.117g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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