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Home > Boronic Acids > 854502-95-7
854502-95-7 | B-[4-(1-ethyl-1-hydroxypropyl)-2-propylphenyl]boronic acid
CAS No: 854502-95-7 Catalog No: AG00G96J MDL No:
Product Description
Catalog Number:
AG00G96J
Chemical Name:
B-[4-(1-ethyl-1-hydroxypropyl)-2-propylphenyl]boronic acid
CAS Number:
854502-95-7
IUPAC Name:
[4-(3-hydroxypentan-3-yl)-2-propylphenyl]boronic acid
InChI:
InChI=1S/C14H23BO3/c1-4-7-11-10-12(14(16,5-2)6-3)8-9-13(11)15(17)18/h8-10,16-18H,4-7H2,1-3H3
InChI Key:
VFVSMIHLZHGNHB-UHFFFAOYSA-N
Properties
Complexity:
241
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
250.174g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
250.145g/mol
Monoisotopic Mass:
250.174g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
60.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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