69766-31-0
1-(2-(N-(2-CHLOROETHYL)-N-ETHYLAMINO)ETHYL)-1H-BENZOTRIAZOLE HYDROCHLORIDE
Name1-(2-(N-(2-CHLOROETHYL)-N-ETHYLAMINO)ETHYL)-1H-BENZOTRIAZOLE HYDROCHLORIDE
FormulaC12 H17 Cl N4 . Cl H
1Identification
【Name】
1-(2-(N-(2-CHLOROETHYL)-N-ETHYLAMINO)ETHYL)-1H-BENZOTRIAZOLE HYDROCHLORIDE
【CAS】
【MDL】
MFCD01663828
【English Synonyms】
【Formula】
C12 H17 Cl N4 . Cl H
【MolWeight】
289.208
【Inchi】
InChI=1S/C12H17ClN4.ClH/c1-2-16(8-7-13)9-10-17-12-6-4-3-5-11(12)14-15-17;/h3-6H,2,7-10H2,1H3;1H
【InChIKey】
InChIKey=CKXKLAMYUCKSQG-UHFFFAOYSA-N
【SMILES】
CCN(CCn1c2ccccc2nn1)CCCl.Cl
【MOL File】
1-(2-(N-(2-CHLOROETH….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:4
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1-(2-(N-(2-CHLOROETHYL)-N-ETHYLAMINO)ETHYL)-1H-BENZOTRIAZOLE HYDROCHLORIDE.cml