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Home > Boronic Acids > 1236189-81-3
1236189-81-3 | [3-(Cyclohexylmethoxy)phenyl]boronic acid
CAS No: 1236189-81-3 Catalog No: AG009YLT MDL No:MFCD11183196
Product Description
Catalog Number:
AG009YLT
Chemical Name:
[3-(Cyclohexylmethoxy)phenyl]boronic acid
CAS Number:
1236189-81-3
Molecular Formula:
C13H19BO3
Molecular Weight:
234.0992
MDL Number:
MFCD11183196
IUPAC Name:
[3-(cyclohexylmethoxy)phenyl]boronic acid
InChI:
InChI=1S/C13H19BO3/c15-14(16)12-7-4-8-13(9-12)17-10-11-5-2-1-3-6-11/h4,7-9,11,15-16H,1-3,5-6,10H2
InChI Key:
DXVYSTNQUGABIL-UHFFFAOYSA-N
SMILES:
OB(c1cccc(c1)OCC1CCCCC1)O
Properties
Complexity:
217
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.143g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
234.102g/mol
Monoisotopic Mass:
234.143g/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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