1172623-96-9
Carbamic acid, N-[1-(2,5-difluorobenzoyl)-3-butyn-1-yl]-, 1,1-dimethylethyl ester
NameCarbamic acid, N-[1-(2,5-difluorobenzoyl)-3-butyn-1-yl]-, 1,1-dimethylethyl ester
1Identification
【Name】
Carbamic acid, N-[1-(2,5-difluorobenzoyl)-3-butyn-1-yl]-, 1,1-dimethylethyl ester
【CAS】
【MDL】
【English Synonyms】
【Formula】
C16H17F2NO3
【MolWeight】
309.3079
【Inchi】
InChI=1S/C16H17F2NO3/c1-5-6-13(19-15(21)22-16(2,3)4)14(20)11-9-10(17)7-8-12(11)18/h1,7-9,13H,6H2,2-4H3,(H,19,21)
【InChIKey】
InChIKey=FCPUEOMVOKWZQD-UHFFFAOYSA-N
【SMILES】
FC1=C(C(=O)C(CC#C)NC(OC(C)(C)C)=O)C=C(C=C1)F
【MOL File】
Carbamic acid, N-[1-….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:0
XLogP3:0.0
Bulk/Fine:
3Material Safety Data Sheet(MSDS)
4CML File
Carbamic acid, N-[1-(2,5-difluorobenzoyl)-3-butyn-1-yl]-, 1,1-dimethylethyl ester.cml