57272-28-3
BETA-HYDROXY-BETA,2,2,3-TETRAMETHYLCYCLOPENTANEHEXANOIC ACID SODIUM SALT
NameBETA-HYDROXY-BETA,2,2,3-TETRAMETHYLCYCLOPENTANEHEXANOIC ACID SODIUM SALT
1Identification
【Name】
BETA-HYDROXY-BETA,2,2,3-TETRAMETHYLCYCLOPENTANEHEXANOIC ACID SODIUM SALT
【CAS】
【MDL】
MFCD01735444
【English Synonyms】
【Formula】
C15 H27 O3 . Na
【MolWeight】
278.365
【Inchi】
InChI=1S/C15H28O3.Na/c1-11-7-8-12(14(11,2)3)6-5-9-15(4,18)10-13(16)17;/h11-12,18H,5-10H2,1-4H3,(H,16,17);/q;+1/p-1
【InChIKey】
InChIKey=BMQSKAWWTIRIBY-UHFFFAOYSA-M
【SMILES】
CC1CCC(C1(C)C)CCCC(C)(CC(=O)[O-])O.[Na+]
【MOL File】
BETA-HYDROXY-BETA,2,….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:3
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
BETA-HYDROXY-BETA,2,2,3-TETRAMETHYLCYCLOPENTANEHEXANOIC ACID SODIUM SALT.cml