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(1R,5R,6S)-4-(diethylamino)-6-methoxy-3-methyl-6-[4-(trifluoromethyl)phenyl]-1,5-bis(trimethylsilyl)bicyclo[3.1.0]hex-3-en-2-one

HCID 336905
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Basic information

CAS
76833-12-0
Standard SMILES
CCN(CC)C1=C(C)C(=O)[C@]2([Si](C)(C)C)[C@](OC)(c3ccc(C(F)(F)F)cc3)[C@]12[Si](C)(C)C
InChIKey
DLZPQSSSLSHOII-VXNXHJTFSA-N
Molecular formula
C25H38F3NO2Si2
Average molar mass
497.7 g/mol
Monoisotopic mass
497.23931701

Names & identifiers

Preferred name
(1R,5R,6S)-4-(diethylamino)-6-methoxy-3-methyl-6-[4-(trifluoromethyl)phenyl]-1,5-bis(trimethylsilyl)bicyclo[3.1.0]hex-3-en-2-one
IUPAC
(1R,5R,6S)-4-(diethylamino)-6-methoxy-3-methyl-6-[4-(trifluoromethyl)phenyl]-1,5-bis(trimethylsilyl)bicyclo[3.1.0]hex-3-en-2-one

Names & synonyms

NSC35307876833-12-0DTXSID20319969NSC-353078(1R,5R,6S)-4-(diethylamino)-6-methoxy-3-methyl-6-[4-(trifluoromethyl)phenyl]-1,5-bis(trimethylsilyl)bicyclo[3.1.0]hex-3-en-2-one

Database identifiers

CAS
76833-12-0
PubChem CID
336905
DTXSID
DTXSID20319969

Properties

Computed structural properties

Topological polar surface area
29.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
6
Rotatable bonds
7
Heavy atoms
33
Formal charge
0
Complexity
832

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