1085-91-2
2-ETHYL-2-(NAPHTHALEN-1-YL)BUTANOIC ACID
Name2-ETHYL-2-(NAPHTHALEN-1-YL)BUTANOIC ACID
1Identification
【Name】
2-ETHYL-2-(NAPHTHALEN-1-YL)BUTANOIC ACID
【CAS】
【MDL】
MFCD00868726
【English Synonyms】
【Formula】
C16 H18 O2
【MolWeight】
242.316
【Inchi】
InChI=1S/C16H18O2/c1-3-16(4-2,15(17)18)14-11-7-9-12-8-5-6-10-13(12)14/h5-11H,3-4H2,1-2H3,(H,17,18)
【InChIKey】
InChIKey=NONNPKGLUCHFEW-UHFFFAOYSA-N
【SMILES】
CCC(CC)(c1cccc2c1cccc2)C(=O)O
【MOL File】
2-ETHYL-2-(NAPHTHALE….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:2
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2-ETHYL-2-(NAPHTHALEN-1-YL)BUTANOIC ACID.cml