532389-78-9
4-[3-(3-BUTOXY-BENZOYL)-THIOUREIDO]-BENZOIC ACID
Name
4-[3-(3-BUTOXY-BENZOYL)-THIOUREIDO]-BENZOIC ACID
Formula
C19 H20 N2 O4 S
MolWeight
372.443
1Identification
【Name】
4-[3-(3-BUTOXY-BENZOYL)-THIOUREIDO]-BENZOIC ACID
【CAS】
【MDL】
MFCD03569621
【English Synonyms】
【Formula】
C19 H20 N2 O4 S
【MolWeight】
372.443
【Inchi】
InChI=1S/C19H20N2O4S/c1-2-3-11-25-16-6-4-5-14(12-16)17(22)21-19(26)20-15-9-7-13(8-10-15)18(23)24/h4-10,12H,2-3,11H2,1H3,(H,23,24)(H2,20,21,22,26)
【InChIKey】
InChIKey=IWCCLFNWEDBSTP-UHFFFAOYSA-N
【SMILES】
CCCCOc1cccc(c1)C(=O)NC(=S)Nc2ccc(cc2)C(=O)O
【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
4-[3-(3-BUTOXY-BENZOYL)-THIOUREIDO]-BENZOIC ACID.cml
Quick Release
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Catalog No:U80152 nullnull
Country/Region:United States
Business Type:Trading Company
http://www.AsisChem.com
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