Name: Name:Benzoic acid, 2,4-dichloro-, 4-[[4-[(2,4-dichlorobenzoyl)oxy]phenyl]thio]phenyl ester
Brand: Angene
SKU: AG0011MT
Rating: 90 (10 reviews)

Benzoic acid, 2,4-dichloro-, 4-[[4-[(2,4-dichlorobenzoyl)oxy]phenyl]thio]phenyl ester

CAS No.:

1363166-13-5

Catalog Number:

AG0011MT

Molecular Formula:

C26H14Cl4O4S

Molecular Weight:

564.2640

Catalog Number:

AG0011MT

Chemical Name:

Benzoic acid, 2,4-dichloro-, 4-[[4-[(2,4-dichlorobenzoyl)oxy]phenyl]thio]phenyl ester

CAS Number:

1363166-13-5

Molecular Formula:

C26H14Cl4O4S

Molecular Weight:

564.2640

MDL Number:

MFCD01175344

IUPAC Name:

[4-[4-(2,4-dichlorobenzoyl)oxyphenyl]sulfanylphenyl] 2,4-dichlorobenzoate

InChI:

InChI=1S/C26H14Cl4O4S/c27-15-1-11-21(23(29)13-15)25(31)33-17-3-7-19(8-4-17)35-20-9-5-18(6-10-20)34-26(32)22-12-2-16(28)14-24(22)30/h1-14H

InChI Key:

RDEZOIHVBZVMFB-UHFFFAOYSA-N

SMILES:

Clc1ccc(c(c1)Cl)C(=O)Oc1ccc(cc1)Sc1ccc(cc1)OC(=O)c1ccc(cc1Cl)Cl

Complexity:

654

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

563.934g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

564.254g/mol

Monoisotopic Mass:

561.937g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

77.9A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

9.3