532414-48-5
4-CHLORO-3-[3-(2-FLUORO-BENZOYL)-THIOUREIDO]-BENZOIC ACID
Name
4-CHLORO-3-[3-(2-FLUORO-BENZOYL)-THIOUREIDO]-BENZOIC ACID
Formula
C15 H10 Cl F N2 O3 S
MolWeight
352.772
1Identification
【Name】
4-CHLORO-3-[3-(2-FLUORO-BENZOYL)-THIOUREIDO]-BENZOIC ACID
【CAS】
【MDL】
MFCD03569639
【English Synonyms】
【Formula】
C15 H10 Cl F N2 O3 S
【MolWeight】
352.772
【Inchi】
InChI=1S/C15H10ClFN2O3S/c16-10-6-5-8(14(21)22)7-12(10)18-15(23)19-13(20)9-3-1-2-4-11(9)17/h1-7H,(H,21,22)(H2,18,19,20,23)
【InChIKey】
InChIKey=UJYIFPQXYRPRCB-UHFFFAOYSA-N
【SMILES】
c1ccc(c(c1)C(=O)NC(=S)Nc2cc(ccc2Cl)C(=O)O)F
【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
4-CHLORO-3-[3-(2-FLUORO-BENZOYL)-THIOUREIDO]-BENZOIC ACID.cml
Quick Release
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Catalog No:U88491 nullnull
Country/Region:United States
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