4234-79-1
KELEVAN
Name
KELEVAN
Formula
C17 H12 Cl10 O4
MolWeight
634.808
1Identification
【Name】
KELEVAN
【CAS】
【MDL】
MFCD00055538
【English Synonyms】
【Formula】
C17 H12 Cl10 O4
【MolWeight】
634.808
【Inchi】
InChI=1S/C17H12Cl10O4/c1-2-31-7(29)4-3-6(28)5-8(30)9(18)11(20)13(22)10(8,19)14(23)12(9,21)15(11,24)17(26,27)16(13,14)25/h30H,2-5H2,1H3
【InChIKey】
InChIKey=POSKOXIJDWDKPH-UHFFFAOYSA-N
【SMILES】
CCOC(=O)CCC(=O)CC1(C2(C3(C4(C1(C5(C2(C3(C(C45Cl)(Cl)Cl)Cl)Cl)Cl)Cl)Cl)Cl)Cl)O
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:4
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
KELEVAN.cml
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