531540-54-2
5-IODO-2-[[[(PHENOXYACETYL)AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID
Name
5-IODO-2-[[[(PHENOXYACETYL)AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID
Formula
C16 H13 I N2 O4 S
MolWeight
456.255
1Identification
【Name】
5-IODO-2-[[[(PHENOXYACETYL)AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID
【CAS】
【MDL】
MFCD03566323
【English Synonyms】
【Formula】
C16 H13 I N2 O4 S
【MolWeight】
456.255
【Inchi】
InChI=1S/C16H13IN2O4S/c17-10-6-7-13(12(8-10)15(21)22)18-16(24)19-14(20)9-23-11-4-2-1-3-5-11/h1-8H,9H2,(H,21,22)(H2,18,19,20,24)
【InChIKey】
InChIKey=MSMDHEJISHIXFG-UHFFFAOYSA-N
【SMILES】
c1ccc(cc1)OCC(=O)NC(=S)Nc2ccc(cc2C(=O)O)I
【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
5-IODO-2-[[[(PHENOXYACETYL)AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID.cml
Quick Release
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AsisChem, Inc.
Catalog No:U82584 nullnull
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Catalog No:U82584 nullnull
Country/Region:United States
Business Type:Trading Company
http://www.AsisChem.com
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