834885-44-8
CYCLOPENTANECARBONITRILE, 1-HYDROXY-2-(2-PROPENYL)-, (1R,2R)-REL-
NameCYCLOPENTANECARBONITRILE, 1-HYDROXY-2-(2-PROPENYL)-, (1R,2R)-REL-
1Identification
【Name】
CYCLOPENTANECARBONITRILE, 1-HYDROXY-2-(2-PROPENYL)-, (1R,2R)-REL-
【CAS】
【MDL】
MFCD17017812
【English Synonyms】
【Formula】
C9H13NO
【MolWeight】
151.208
【Inchi】
InChI=1S/C9H13NO/c1-2-4-8-5-3-6-9(8,11)7-10/h2,8,11H,1,3-6H2/t8-,9-/m0/s1
【InChIKey】
InChIKey=BHPWVDVWWSFLGO-IUCAKERBSA-N
【SMILES】
O[C@@]1(CCC[C@@H]1CC=C)C#N
【MOL File】
CYCLOPENTANECARBONIT….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:2
XLogP3:2.0987
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
CYCLOPENTANECARBONITRILE, 1-HYDROXY-2-(2-PROPENYL)-, (1R,2R)-REL-.cml