57269-38-2
3-METHYL-8-VALERYL-3,8-DIAZABICYCLO[3.2.1]OCTANE
Name3-METHYL-8-VALERYL-3,8-DIAZABICYCLO[3.2.1]OCTANE
1Identification
【Name】
3-METHYL-8-VALERYL-3,8-DIAZABICYCLO[3.2.1]OCTANE
【CAS】
【MDL】
MFCD01731670
【English Synonyms】
【Formula】
C12 H22 N2 O
【MolWeight】
210.319
【Inchi】
InChI=1S/C12H22N2O/c1-3-4-5-12(15)14-10-6-7-11(14)9-13(2)8-10/h10-11H,3-9H2,1-2H3/t10-,11+
【InChIKey】
InChIKey=OHMYIIRCLXKUMF-PHIMTYICSA-N
【SMILES】
CCCCC(=O)N1[C@@H]2CC[C@H]1CN(C2)C
【MOL File】
3-METHYL-8-VALERYL-3….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:3
XLogP3:1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
3-METHYL-8-VALERYL-3,8-DIAZABICYCLO[3.2.1]OCTANE.cml