532948-64-4
3-(3-BENZOYL-THIOUREIDO)-4-CHLORO-BENZOIC ACID
Name
3-(3-BENZOYL-THIOUREIDO)-4-CHLORO-BENZOIC ACID
Formula
C15 H11 Cl N2 O3 S
MolWeight
334.782
1Identification
【Name】
3-(3-BENZOYL-THIOUREIDO)-4-CHLORO-BENZOIC ACID
【CAS】
【MDL】
MFCD03573863
【English Synonyms】
【Formula】
C15 H11 Cl N2 O3 S
【MolWeight】
334.782
【Inchi】
InChI=1S/C15H11ClN2O3S/c16-11-7-6-10(14(20)21)8-12(11)17-15(22)18-13(19)9-4-2-1-3-5-9/h1-8H,(H,20,21)(H2,17,18,19,22)
【InChIKey】
InChIKey=HWYGPBLJIDYXQY-UHFFFAOYSA-N
【SMILES】
c1ccc(cc1)C(=O)NC(=S)Nc2cc(ccc2Cl)C(=O)O
【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
3-(3-BENZOYL-THIOUREIDO)-4-CHLORO-BENZOIC ACID.cml
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Catalog No:U76771 nullnull
Country/Region:United States
Business Type:Trading Company
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