769142-83-8
1-(2-((4-ALLYL-2-METHOXYPHENOXY)AC)CARBOHYDRAZONOYL)-2-NAPHTHYL 4-METHYLBENZOATE
Name1-(2-((4-ALLYL-2-METHOXYPHENOXY)AC)CARBOHYDRAZONOYL)-2-NAPHTHYL 4-METHYLBENZOATE
1Identification
【Name】
1-(2-((4-ALLYL-2-METHOXYPHENOXY)AC)CARBOHYDRAZONOYL)-2-NAPHTHYL 4-METHYLBENZOATE
【CAS】
【MDL】
MFCD05151964
【English Synonyms】
【Formula】
C31 H28 N2 O5
【MolWeight】
508.571
【Inchi】
InChI=1S/C31H28N2O5/c1-4-7-22-12-16-28(29(18-22)36-3)37-20-30(34)33-32-19-26-25-9-6-5-8-23(25)15-17-27(26)38-31(35)24-13-10-21(2)11-14-24/h4-6,8-19H,1,7,20H2,2-3H3,(H,33,34)/b32-19+
【InChIKey】
InChIKey=HIDPEQSMYRGVEK-BIZUNTBRSA-N
【SMILES】
Cc1ccc(cc1)C(=O)Oc2ccc3ccccc3c2/C=N/NC(=O)COc4ccc(cc4OC)CC=C
【MOL File】
1-(2-((4-ALLYL-2-MET….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:7
XLogP3:6.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1-(2-((4-ALLYL-2-METHOXYPHENOXY)AC)CARBOHYDRAZONOYL)-2-NAPHTHYL 4-METHYLBENZOATE.cml