718601-42-4
4-[[(5-ETHYL-2-FURANYL)CARBONYL]AMINO]-BENZOIC ACID
Name4-[[(5-ETHYL-2-FURANYL)CARBONYL]AMINO]-BENZOIC ACID
1Identification
【Name】
4-[[(5-ETHYL-2-FURANYL)CARBONYL]AMINO]-BENZOIC ACID
【CAS】
【MDL】
MFCD05240834
【English Synonyms】
【Formula】
C14 H13 N O4
【MolWeight】
259.26
【Inchi】
InChI=1S/C14H13NO4/c1-2-11-7-8-12(19-11)13(16)15-10-5-3-9(4-6-10)14(17)18/h3-8H,2H2,1H3,(H,15,16)(H,17,18)
【InChIKey】
InChIKey=NAIDGFMJDNVOST-UHFFFAOYSA-N
【SMILES】
CCc1ccc(o1)C(=O)Nc2ccc(cc2)C(=O)O
【MOL File】
4-[[(5-ETHYL-2-FURAN….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:5
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4-[[(5-ETHYL-2-FURANYL)CARBONYL]AMINO]-BENZOIC ACID.cml