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740834-60-0 | Borinic acid, bis(2,6,6-trimethylbicyclo[3.1.1]hept-3-yl)-, cyclohexyl ester
CAS No: 740834-60-0 Catalog No: AG0059LH MDL No:
Product Description
Catalog Number:
AG0059LH
Chemical Name:
Borinic acid, bis(2,6,6-trimethylbicyclo[3.1.1]hept-3-yl)-, cyclohexyl ester
CAS Number:
740834-60-0
Molecular Formula:
C26H45BO
Molecular Weight:
384.4459
IUPAC Name:
cyclohexyloxy-bis(2,6,6-trimethyl-3-bicyclo[3.1.1]heptanyl)borane
InChI:
InChI=1S/C26H45BO/c1-16-21-12-18(25(21,3)4)14-23(16)27(28-20-10-8-7-9-11-20)24-15-19-13-22(17(24)2)26(19,5)6/h16-24H,7-15H2,1-6H3
InChI Key:
UQPSWBKFHJLCCL-UHFFFAOYSA-N
SMILES:
CC1C(CC2CC1C2(C)C)B(C1CC2CC(C1C)C2(C)C)OC1CCCCC1
Properties
Complexity:
549
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
384.356g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
384.455g/mol
Monoisotopic Mass:
384.356g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
8
Undefined Bond Stereocenter Count:
0
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