5107-67-5
2-OXO-1,1,3,3-CYCLOHEXANETETRAPROPIONIC ACID
Name
2-OXO-1,1,3,3-CYCLOHEXANETETRAPROPIONIC ACID
Formula
C18 H26 O9
MolWeight
386.394
1Identification
【Name】
2-OXO-1,1,3,3-CYCLOHEXANETETRAPROPIONIC ACID
【CAS】
【MDL】
MFCD00019463
【English Synonyms】
【Formula】
C18 H26 O9
【MolWeight】
386.394
【Inchi】
InChI=1S/C18H26O9/c19-12(20)2-8-17(9-3-13(21)22)6-1-7-18(16(17)27,10-4-14(23)24)11-5-15(25)26/h1-11H2,(H,19,20)(H,21,22)(H,23,24)(H,25,26)
【InChIKey】
InChIKey=CIVMSMDSVPVXSU-UHFFFAOYSA-N
【SMILES】
C1CC(C(=O)C(C1)(CCC(=O)O)CCC(=O)O)(CCC(=O)O)CCC(=O)O
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:4
H bond acceptor:9
XLogP3:1.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
4CML File
2-OXO-1,1,3,3-CYCLOHEXANETETRAPROPIONIC ACID.cml
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