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Home > Boronic Acids > 880349-00-8
880349-00-8 | (2-propylphenyl)boronic acid
CAS No: 880349-00-8 Catalog No: AG01BXU9 MDL No:MFCD14682925
Product Description
Catalog Number:
AG01BXU9
Chemical Name:
(2-propylphenyl)boronic acid
CAS Number:
880349-00-8
Molecular Formula:
C9H13BO2
Molecular Weight:
164.0093
MDL Number:
MFCD14682925
IUPAC Name:
(2-propylphenyl)boronic acid
InChI:
InChI=1S/C9H13BO2/c1-2-5-8-6-3-4-7-9(8)10(11)12/h3-4,6-7,11-12H,2,5H2,1H3
InChI Key:
OUZANECXUCYGEG-UHFFFAOYSA-N
SMILES:
CCCc1ccccc1B(O)O
Properties
Complexity:
128
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:
3
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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