532386-17-7
3,5-DICHLORO-2-[[[(2,5-DICHLOROBENZOYL)AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID
Name
3,5-DICHLORO-2-[[[(2,5-DICHLOROBENZOYL)AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID
Formula
C15 H8 Cl4 N2 O3 S
MolWeight
438.117
1Identification
【Name】
3,5-DICHLORO-2-[[[(2,5-DICHLOROBENZOYL)AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID
【CAS】
【MDL】
MFCD03569291
【English Synonyms】
【Formula】
C15 H8 Cl4 N2 O3 S
【MolWeight】
438.117
【Inchi】
InChI=1S/C15H8Cl4N2O3S/c16-6-1-2-10(18)8(3-6)13(22)21-15(25)20-12-9(14(23)24)4-7(17)5-11(12)19/h1-5H,(H,23,24)(H2,20,21,22,25)
【InChIKey】
InChIKey=XQVPUAQQDLHNSH-UHFFFAOYSA-N
【SMILES】
c1cc(c(cc1Cl)C(=O)NC(=S)Nc2c(cc(cc2Cl)Cl)C(=O)O)Cl
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:3
H bond acceptor:5
XLogP3:5.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
3,5-DICHLORO-2-[[[(2,5-DICHLOROBENZOYL)AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID.cml
Quick Release
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