18672-07-6
PROPANOIC ACID, 2-(4-CYANOPHENOXY)-2-METHYL-, ETHYL ESTER
NamePROPANOIC ACID, 2-(4-CYANOPHENOXY)-2-METHYL-, ETHYL ESTER
1Identification
【Name】
PROPANOIC ACID, 2-(4-CYANOPHENOXY)-2-METHYL-, ETHYL ESTER
【CAS】
【MDL】
MFCD01697488
【English Synonyms】
【Formula】
C13 H15 N O3
【MolWeight】
233.266
【Inchi】
InChI=1S/C13H15NO3/c1-4-16-12(15)13(2,3)17-11-7-5-10(9-14)6-8-11/h5-8H,4H2,1-3H3
【InChIKey】
InChIKey=CXAFOUVBWLSQHX-UHFFFAOYSA-N
【SMILES】
CCOC(=O)C(C)(C)Oc1ccc(cc1)C#N
【MOL File】
PROPANOIC ACID, 2-(4….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:4
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
PROPANOIC ACID, 2-(4-CYANOPHENOXY)-2-METHYL-, ETHYL ESTER.cml