5173-46-6
ESTRA-4,9-DIENE-3,17-DIONE
Name
ESTRA-4,9-DIENE-3,17-DIONE
Formula
C18 H22 O2
MolWeight
270.37
1Identification
【Name】
ESTRA-4,9-DIENE-3,17-DIONE
【CAS】
【MDL】
MFCD03695567
【English Synonyms】
【Formula】
C18 H22 O2
【MolWeight】
270.37
【Inchi】
InChI=1S/C18H22O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h10,15-16H,2-9H2,1H3/t15-,16+,18+/m1/s1
【InChIKey】
InChIKey=BHTWZQKERRCPRZ-RYRKJORJSA-N
【SMILES】
C[C@]12CCC3=C4CCC(=O)C=C4CC[C@H]3[C@@H]1CCC2=O
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:2
XLogP3:2.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
4CML File
ESTRA-4,9-DIENE-3,17-DIONE.cml
Quick Release
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