74058-75-6
BENZYL [2-(1H-IMIDAZOL-4-YL)ETHYL]CARBAMATE
NameBENZYL [2-(1H-IMIDAZOL-4-YL)ETHYL]CARBAMATE
1Identification
【Name】
BENZYL [2-(1H-IMIDAZOL-4-YL)ETHYL]CARBAMATE
【CAS】
【MDL】
MFCD10697672
【English Synonyms】
【Formula】
C13 H15 N3 O2
【MolWeight】
245.281
【Inchi】
InChI=1S/C13H15N3O2/c17-13(15-7-6-12-8-14-10-16-12)18-9-11-4-2-1-3-5-11/h1-5,8,10H,6-7,9H2,(H,14,16)(H,15,17)
【InChIKey】
InChIKey=PZYMWDPVQFBCDD-UHFFFAOYSA-N
【SMILES】
c1ccc(cc1)COC(=O)NCCc2c[nH]cn2
【MOL File】
BENZYL [2-(1H-IMIDAZ….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:5
XLogP3:1.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
4CML File
BENZYL [2-(1H-IMIDAZOL-4-YL)ETHYL]CARBAMATE.cml