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Home > Boronic Acids > 16152-51-5
16152-51-5 | Boronic acid, B-[4-(1-methylethyl)phenyl]-
CAS No: 16152-51-5 Catalog No: AG001VO8 MDL No:MFCD01074614
Product Description
Catalog Number:
AG001VO8
Chemical Name:
Boronic acid, B-[4-(1-methylethyl)phenyl]-
CAS Number:
16152-51-5
Molecular Formula:
C9H13BO2
Molecular Weight:
164.0093
MDL Number:
MFCD01074614
IUPAC Name:
(4-propan-2-ylphenyl)boronic acid
InChI:
InChI=1S/C9H13BO2/c1-7(2)8-3-5-9(6-4-8)10(11)12/h3-7,11-12H,1-2H3
InChI Key:
IAEUFBDMVKQCLU-UHFFFAOYSA-N
SMILES:
OB(c1ccc(cc1)C(C)C)O
Properties
Complexity:
129
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
164.101g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
164.011g/mol
Monoisotopic Mass:
164.101g/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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