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Home > Boronic Acids > 851119-07-8
851119-07-8 | Boronic acid, (7-chloro-9,9-dicyclohexyl-9H-fluoren-2-yl)-
CAS No: 851119-07-8 Catalog No: AG004OH9 MDL No:
Product Description
Catalog Number:
AG004OH9
Chemical Name:
Boronic acid, (7-chloro-9,9-dicyclohexyl-9H-fluoren-2-yl)-
CAS Number:
851119-07-8
Molecular Formula:
C25H30BClO2
Molecular Weight:
408.7685
IUPAC Name:
(7-chloro-9,9-dicyclohexylfluoren-2-yl)boronic acid
InChI:
InChI=1S/C25H30BClO2/c27-20-12-14-22-21-13-11-19(26(28)29)15-23(21)25(24(22)16-20,17-7-3-1-4-8-17)18-9-5-2-6-10-18/h11-18,28-29H,1-10H2
InChI Key:
MROQLOLHADUCIW-UHFFFAOYSA-N
SMILES:
Clc1ccc2c(c1)C(C1CCCCC1)(C1CCCCC1)c1c2ccc(c1)B(O)O
Properties
Complexity:
539
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
408.203g/mol
Formal Charge:
0
Heavy Atom Count:
29
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
408.773g/mol
Monoisotopic Mass:
408.203g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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