855754-09-5
3-METHOXY-2-METHYL-CINCHONINONITRILE
Name3-METHOXY-2-METHYL-CINCHONINONITRILE
1Identification
【Name】
3-METHOXY-2-METHYL-CINCHONINONITRILE
【CAS】
【MDL】
MFCD16878099
【English Synonyms】
【Formula】
C12 H10 N2 O
【MolWeight】
198.224
【Inchi】
InChI=1S/C12H10N2O/c1-8-12(15-2)10(7-13)9-5-3-4-6-11(9)14-8/h3-6H,1-2H3
【InChIKey】
InChIKey=VUFQZDRZUGCUGW-UHFFFAOYSA-N
【SMILES】
Cc1c(c(c2ccccc2n1)C#N)OC
【MOL File】
3-METHOXY-2-METHYL-C….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
3-METHOXY-2-METHYL-CINCHONINONITRILE.cml