5698-27-1
3,7-DIMETHYLOCTANOIC ACID
Name
3,7-DIMETHYLOCTANOIC ACID
Formula
C10 H20 O2
MolWeight
172.266
1Identification
【Name】
3,7-DIMETHYLOCTANOIC ACID
【CAS】
【MDL】
MFCD02258579
【English Synonyms】
【Formula】
C10 H20 O2
【MolWeight】
172.266
【Inchi】
InChI=1S/C10H20O2/c1-8(2)5-4-6-9(3)7-10(11)12/h8-9H,4-7H2,1-3H3,(H,11,12)
【InChIKey】
InChIKey=DGGBNSXAFVNQJU-UHFFFAOYSA-N
【SMILES】
CC(C)CCCC(C)CC(=O)O
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:2
XLogP3:3.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
3,7-DIMETHYLOCTANOIC ACID.cml
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