554453-20-2
TERT-BUTYL (2-(1H-PYRROLO[3,2-B]PYRIDIN-3-YL)ETHYL)CARBAMATE
NameTERT-BUTYL (2-(1H-PYRROLO[3,2-B]PYRIDIN-3-YL)ETHYL)CARBAMATE
1Identification
【Name】
TERT-BUTYL (2-(1H-PYRROLO[3,2-B]PYRIDIN-3-YL)ETHYL)CARBAMATE
【CAS】
【MDL】
MFCD18262236
【English Synonyms】
【Formula】
C14 H19 N3 O2
【MolWeight】
261.323
【Inchi】
InChI=1S/C14H19N3O2/c1-14(2,3)19-13(18)16-8-6-10-9-17-11-5-4-7-15-12(10)11/h4-5,7,9,17H,6,8H2,1-3H3,(H,16,18)
【InChIKey】
InChIKey=XPSOLHQUEIPEBK-UHFFFAOYSA-N
【SMILES】
CC(C)(C)OC(=O)NCCc1c[nH]c2c1nccc2
【MOL File】
TERT-BUTYL (2-(1H-PY….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:5
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
TERT-BUTYL (2-(1H-PYRROLO[3,2-B]PYRIDIN-3-YL)ETHYL)CARBAMATE.cml