59042-09-0
(S)-1-(5,6-DIHYDRO-2H-PYRAN-2-YL)-1H-BENZIMIDAZOLE
Name(S)-1-(5,6-DIHYDRO-2H-PYRAN-2-YL)-1H-BENZIMIDAZOLE
1Identification
【Name】
(S)-1-(5,6-DIHYDRO-2H-PYRAN-2-YL)-1H-BENZIMIDAZOLE
【CAS】
【MDL】
MFCD18827817
【English Synonyms】
【Formula】
C12 H12 N2 O
【MolWeight】
200.24
【Inchi】
InChI=1S/C12H12N2O/c1-2-6-11-10(5-1)13-9-14(11)12-7-3-4-8-15-12/h1-3,5-7,9,12H,4,8H2/t12-/m0/s1
【InChIKey】
InChIKey=QGTCNVJGIZRKGF-LBPRGKRZSA-N
【SMILES】
c1ccc2c(c1)ncn2[C@@H]3C=CCCO3
【MOL File】
(S)-1-(5,6-DIHYDRO-2….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:3
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
(S)-1-(5,6-DIHYDRO-2H-PYRAN-2-YL)-1H-BENZIMIDAZOLE.cml