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Home > Boronic Acids > 90002-36-1
90002-36-1 | 2-Ethylphenylboronic acid
CAS No: 90002-36-1 Catalog No: AG003H85 MDL No:MFCD02093075
Product Description
Catalog Number:
AG003H85
Chemical Name:
2-Ethylphenylboronic acid
CAS Number:
90002-36-1
Molecular Formula:
C8H11BO2
Molecular Weight:
149.9827
MDL Number:
MFCD02093075
IUPAC Name:
(2-ethylphenyl)boronic acid
InChI:
InChI=1S/C8H11BO2/c1-2-7-5-3-4-6-8(7)9(10)11/h3-6,10-11H,2H2,1H3
InChI Key:
QSSPYZOSTJDTTL-UHFFFAOYSA-N
SMILES:
CCc1ccccc1B(O)O
Properties
Complexity:
117
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
150.085g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
149.984g/mol
Monoisotopic Mass:
150.085g/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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