92375-81-0
NICOTINIC ACID (ALPHA-ETHYL-5-METHYL-2-THENYLIDENE)HYDRAZIDE
NameNICOTINIC ACID (ALPHA-ETHYL-5-METHYL-2-THENYLIDENE)HYDRAZIDE
1Identification
【Name】
NICOTINIC ACID (ALPHA-ETHYL-5-METHYL-2-THENYLIDENE)HYDRAZIDE
【CAS】
【MDL】
MFCD01711753
【English Synonyms】
【Formula】
C14 H15 N3 O S
【MolWeight】
273.358
【Inchi】
InChI=1S/C14H15N3OS/c1-3-12(13-7-6-10(2)19-13)16-17-14(18)11-5-4-8-15-9-11/h4-9H,3H2,1-2H3,(H,17,18)/b16-12+
【InChIKey】
InChIKey=KTQYIXRCZQFMDB-FOWTUZBSSA-N
【SMILES】
CC/C(=N\NC(=O)c1cccnc1)/c2ccc(s2)C
【MOL File】
NICOTINIC ACID (ALPH….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:4
XLogP3:3.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
NICOTINIC ACID (ALPHA-ETHYL-5-METHYL-2-THENYLIDENE)HYDRAZIDE.cml