200,000+ products from a single source!
sales@angenechem.com
Home > Boronic Acids > 130870-16-5
130870-16-5 | Boronic acid, (2,5-didodecyl-1,4-phenylene)bis- (9CI)
CAS No: 130870-16-5 Catalog No: AG000V1P MDL No:
Product Description
Catalog Number:
AG000V1P
Chemical Name:
Boronic acid, (2,5-didodecyl-1,4-phenylene)bis- (9CI)
CAS Number:
130870-16-5
Molecular Formula:
C30H56B2O4
Molecular Weight:
502.3852
IUPAC Name:
(4-borono-2,5-didodecylphenyl)boronic acid
InChI:
InChI=1S/C30H56B2O4/c1-3-5-7-9-11-13-15-17-19-21-23-27-25-30(32(35)36)28(26-29(27)31(33)34)24-22-20-18-16-14-12-10-8-6-4-2/h25-26,33-36H,3-24H2,1-2H3
InChI Key:
DJEMIKQUMRVMLD-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCc1cc(B(O)O)c(cc1B(O)O)CCCCCCCCCCCC
Properties
Complexity:
436
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
502.436g/mol
Formal Charge:
0
Heavy Atom Count:
36
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
502.394g/mol
Monoisotopic Mass:
502.436g/mol
Rotatable Bond Count:
24
Topological Polar Surface Area:
80.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.