310905-92-1
2-CYCLOHEPTEN-1-ONE, 5-(1-METHYLETHYL)-, (5R)-
Name2-CYCLOHEPTEN-1-ONE, 5-(1-METHYLETHYL)-, (5R)-
1Identification
【Name】
2-CYCLOHEPTEN-1-ONE, 5-(1-METHYLETHYL)-, (5R)-
【CAS】
【MDL】
MFCD18835988
【English Synonyms】
【Formula】
C10 H16 O
【MolWeight】
152.235
【Inchi】
InChI=1S/C10H16O/c1-8(2)9-4-3-5-10(11)7-6-9/h3,5,8-9H,4,6-7H2,1-2H3/t9-/m0/s1
【InChIKey】
InChIKey=AJIAOAOLKVNRQR-VIFPVBQESA-N
【SMILES】
CC(C)[C@@H]1CCC(=O)C=CC1
【MOL File】
2-CYCLOHEPTEN-1-ONE,….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:1
XLogP3:3.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2-CYCLOHEPTEN-1-ONE, 5-(1-METHYLETHYL)-, (5R)-.cml