530150-40-4
3-[[[[(4-CHLORO-2-METHYLPHENOXY)ACETYL]AMINO]THIOXOMETHYL]AMINO]-2-METHYL-BENZOIC ACID
Name
3-[[[[(4-CHLORO-2-METHYLPHENOXY)ACETYL]AMINO]THIOXOMETHYL]AMINO]-2-METHYL-BENZOIC ACID
Formula
C18 H17 Cl N2 O4 S
MolWeight
392.861
1Identification
【Name】
3-[[[[(4-CHLORO-2-METHYLPHENOXY)ACETYL]AMINO]THIOXOMETHYL]AMINO]-2-METHYL-BENZOIC ACID
【CAS】
【MDL】
MFCD03565011
【English Synonyms】
【Formula】
C18 H17 Cl N2 O4 S
【MolWeight】
392.861
【Inchi】
InChI=1S/C18H17ClN2O4S/c1-10-8-12(19)6-7-15(10)25-9-16(22)21-18(26)20-14-5-3-4-13(11(14)2)17(23)24/h3-8H,9H2,1-2H3,(H,23,24)(H2,20,21,22,26)
【InChIKey】
InChIKey=BJUIBOWUQPGYJL-UHFFFAOYSA-N
【SMILES】
Cc1cc(ccc1OCC(=O)NC(=S)Nc2cccc(c2C)C(=O)O)Cl
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:3
H bond acceptor:6
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
3-[[[[(4-CHLORO-2-METHYLPHENOXY)ACETYL]AMINO]THIOXOMETHYL]AMINO]-2-METHYL-BENZOIC ACID.cml
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Catalog No:U86502 nullnull
Country/Region:United States
Business Type:Trading Company
http://www.AsisChem.com
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