139266-45-8
ACETIC ACID, (4-CHLORO-5-(4-METHYLPHENYL)-3-OXO-2(3H)-FURANYLIDENE)-, ETHYL ESTER
Name
ACETIC ACID, (4-CHLORO-5-(4-METHYLPHENYL)-3-OXO-2(3H)-FURANYLIDENE)-, ETHYL ESTER
Formula
C15 H13 Cl O4
MolWeight
292.717
1Identification
【Name】
ACETIC ACID, (4-CHLORO-5-(4-METHYLPHENYL)-3-OXO-2(3H)-FURANYLIDENE)-, ETHYL ESTER
【CAS】
【MDL】
MFCD01751318
【English Synonyms】
【Formula】
C15 H13 Cl O4
【MolWeight】
292.717
【Inchi】
InChI=1S/C15H13ClO4/c1-3-19-12(17)8-11-14(18)13(16)15(20-11)10-6-4-9(2)5-7-10/h4-8H,3H2,1-2H3/b11-8+
【InChIKey】
InChIKey=VSQZEJBKDQWMAW-DHZHZOJOSA-N
【SMILES】
CCOC(=O)/C=C/1\C(=O)C(=C(O1)c2ccc(cc2)C)Cl
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:4
XLogP3:3.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
ACETIC ACID, (4-CHLORO-5-(4-METHYLPHENYL)-3-OXO-2(3H)-FURANYLIDENE)-, ETHYL ESTER.cml
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