535961-34-3
3H-1,2,4-TRIAZOL-3-ONE, 4-ETHYL-2,4-DIHYDRO-2-(PHENYLMETHYL)-
Name3H-1,2,4-TRIAZOL-3-ONE, 4-ETHYL-2,4-DIHYDRO-2-(PHENYLMETHYL)-
1Identification
【Name】
3H-1,2,4-TRIAZOL-3-ONE, 4-ETHYL-2,4-DIHYDRO-2-(PHENYLMETHYL)-
【CAS】
【MDL】
MFCD18818069
【English Synonyms】
【Formula】
C11 H13 N3 O
【MolWeight】
203.244
【Inchi】
InChI=1S/C11H13N3O/c1-2-13-9-12-14(11(13)15)8-10-6-4-3-5-7-10/h3-7,9H,2,8H2,1H3
【InChIKey】
InChIKey=JYRZIJFWEZKDEH-UHFFFAOYSA-N
【SMILES】
CCn1cnn(c1=O)Cc2ccccc2
【MOL File】
3H-1,2,4-TRIAZOL-3-O….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:4
XLogP3:1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
3H-1,2,4-TRIAZOL-3-ONE, 4-ETHYL-2,4-DIHYDRO-2-(PHENYLMETHYL)-.cml