532943-40-1
2-[[[[3-(4-CHLOROPHENYL)-1-OXO-2-PROPENYL]AMINO]THIOXOMETHYL]AMINO]-5-IODO-BENZOIC ACID
Name
2-[[[[3-(4-CHLOROPHENYL)-1-OXO-2-PROPENYL]AMINO]THIOXOMETHYL]AMINO]-5-IODO-BENZOIC ACID
Formula
C17 H12 Cl I N2 O3 S
MolWeight
486.712
1Identification
【Name】
2-[[[[3-(4-CHLOROPHENYL)-1-OXO-2-PROPENYL]AMINO]THIOXOMETHYL]AMINO]-5-IODO-BENZOIC ACID
【CAS】
【MDL】
MFCD03571057
【English Synonyms】
【Formula】
C17 H12 Cl I N2 O3 S
【MolWeight】
486.712
【Inchi】
InChI=1S/C17H12ClIN2O3S/c18-11-4-1-10(2-5-11)3-8-15(22)21-17(25)20-14-7-6-12(19)9-13(14)16(23)24/h1-9H,(H,23,24)(H2,20,21,22,25)/b8-3+
【InChIKey】
InChIKey=QNHQHJNJCZNLNL-FPYGCLRLSA-N
【SMILES】
c1cc(ccc1/C=C/C(=O)NC(=S)Nc2ccc(cc2C(=O)O)I)Cl
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:3
H bond acceptor:5
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2-[[[[3-(4-CHLOROPHENYL)-1-OXO-2-PROPENYL]AMINO]THIOXOMETHYL]AMINO]-5-IODO-BENZOIC ACID.cml
Quick Release
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AsisChem, Inc.
Catalog No:U82413 nullnull
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Catalog No:U82413 nullnull
Country/Region:United States
Business Type:Trading Company
http://www.AsisChem.com
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