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Home > Boronic Acids > 1313760-64-3
1313760-64-3 | [2-(cyclopentyloxy)-5-methylphenyl]boronic acid
CAS No: 1313760-64-3 Catalog No: AG01A4XK MDL No:MFCD11103735
Product Description
Catalog Number:
AG01A4XK
Chemical Name:
[2-(cyclopentyloxy)-5-methylphenyl]boronic acid
CAS Number:
1313760-64-3
Molecular Formula:
C12H17BO3
Molecular Weight:
220.0726
MDL Number:
MFCD11103735
IUPAC Name:
(2-cyclopentyloxy-5-methylphenyl)boronic acid
InChI:
InChI=1S/C12H17BO3/c1-9-6-7-12(11(8-9)13(14)15)16-10-4-2-3-5-10/h6-8,10,14-15H,2-5H2,1H3
InChI Key:
GGLMKUJEQSKWOG-UHFFFAOYSA-N
SMILES:
Cc1ccc(c(c1)B(O)O)OC1CCCC1
Properties
Complexity:
216
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
220.127g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
220.075g/mol
Monoisotopic Mass:
220.127g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
49.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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