869942-21-2
(1-TERT-BUTYL-2,5-DIMETHYL-1H-PYRROL-3-YL)METHANOL
Name(1-TERT-BUTYL-2,5-DIMETHYL-1H-PYRROL-3-YL)METHANOL
1Identification
【Name】
(1-TERT-BUTYL-2,5-DIMETHYL-1H-PYRROL-3-YL)METHANOL
【CAS】
【MDL】
MFCD09754586
【English Synonyms】
【Formula】
C11 H19 N O
【MolWeight】
181.277
【Inchi】
InChI=1S/C11H19NO/c1-8-6-10(7-13)9(2)12(8)11(3,4)5/h6,13H,7H2,1-5H3
【InChIKey】
InChIKey=XCTQFLOKOHNPCV-UHFFFAOYSA-N
【SMILES】
Cc1cc(c(n1C(C)(C)C)C)CO
【MOL File】
(1-TERT-BUTYL-2,5-DI….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:2
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
(1-TERT-BUTYL-2,5-DIMETHYL-1H-PYRROL-3-YL)METHANOL.cml