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Home > Boronic Acids > 570398-88-8
570398-88-8 | Boronic acid, [4-(cyclohexyloxy)phenyl]-
CAS No: 570398-88-8 Catalog No: AG00IA6G MDL No:MFCD08701752
Product Description
Catalog Number:
AG00IA6G
Chemical Name:
Boronic acid, [4-(cyclohexyloxy)phenyl]-
CAS Number:
570398-88-8
Molecular Formula:
C12H17BO3
Molecular Weight:
220.0726
MDL Number:
MFCD08701752
IUPAC Name:
(4-cyclohexyloxyphenyl)boronic acid
InChI:
InChI=1S/C12H17BO3/c14-13(15)10-6-8-12(9-7-10)16-11-4-2-1-3-5-11/h6-9,11,14-15H,1-5H2
InChI Key:
LRWBGLILWSKAMP-UHFFFAOYSA-N
SMILES:
OB(c1ccc(cc1)OC1CCCCC1)O
Properties
Complexity:
196
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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