200,000+ products from a single source!
sales@angenechem.com
79785-86-7 | Benzoic acid, 4-(dodecyloxy)-, 2,4,5-trichlorophenyl ester
CAS No: 79785-86-7 Catalog No: AG005062 MDL No:
Product Description
Catalog Number:
AG005062
Chemical Name:
Benzoic acid, 4-(dodecyloxy)-, 2,4,5-trichlorophenyl ester
CAS Number:
79785-86-7
Molecular Formula:
C25H31Cl3O3
Molecular Weight:
485.8708
IUPAC Name:
(2,4,5-trichlorophenyl) 4-dodecoxybenzoate
InChI:
InChI=1S/C25H31Cl3O3/c1-2-3-4-5-6-7-8-9-10-11-16-30-20-14-12-19(13-15-20)25(29)31-24-18-22(27)21(26)17-23(24)28/h12-15,17-18H,2-11,16H2,1H3
InChI Key:
BVLYOVGHGJPTRV-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCOc1ccc(cc1)C(=O)Oc1cc(Cl)c(cc1Cl)Cl
Properties
Complexity:
483
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
484.134g/mol
Formal Charge:
0
Heavy Atom Count:
31
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
485.87g/mol
Monoisotopic Mass:
484.134g/mol
Rotatable Bond Count:
15
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
10.8
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.