26110-32-7
2'-CHLORO-5'-[4-(2,4-DI-TERT-PENTYLPHENOXY)BUTYRYLAMINO]-4,4-DIMETHYL-3-OXOPENTANANILIDE
Name2'-CHLORO-5'-[4-(2,4-DI-TERT-PENTYLPHENOXY)BUTYRYLAMINO]-4,4-DIMETHYL-3-OXOPENTANANILIDE
1Identification
【Name】
2'-CHLORO-5'-[4-(2,4-DI-TERT-PENTYLPHENOXY)BUTYRYLAMINO]-4,4-DIMETHYL-3-OXOPENTANANILIDE
【CAS】
【MDL】
MFCD00128824
【English Synonyms】
【Formula】
C33 H47 Cl N2 O4
【MolWeight】
571.197
【Inchi】
InChI=1S/C33H47ClN2O4/c1-10-32(6,7)22-14-17-27(24(19-22)33(8,9)11-2)40-18-12-13-29(38)35-23-15-16-25(34)26(20-23)36-30(39)21-28(37)31(3,4)5/h14-17,19-20H,10-13,18,21H2,1-9H3,(H,35,38)(H,36,39)
【InChIKey】
InChIKey=ITHPSMPRJDBHIR-UHFFFAOYSA-N
【SMILES】
CCC(C)(C)c1ccc(c(c1)C(C)(C)CC)OCCCC(=O)Nc2ccc(c(c2)NC(=O)CC(=O)C(C)(C)C)Cl
【MOL File】
2'-CHLORO-5'-[4-(2,4….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:6
XLogP3:8.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
4CML File
2'-CHLORO-5'-[4-(2,4-DI-TERT-PENTYLPHENOXY)BUTYRYLAMINO]-4,4-DIMETHYL-3-OXOPENTANANILIDE.cml