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(1R,6S)-8,11,11-trimethyl-1-phenylmethoxy-6-phenylsulfanylbicyclo[5.3.1]undec-7-en-3-one

(1R,6S)-8,11,11-trimethyl-1-phenylmethoxy-6-phenylsulfanylbicyclo[5.3.1]undec-7-en-3-one structure

CAS No:
133536-28-4
Formula:
C27H32O2S
Chemical Name:
(1R,6S)-8,11,11-trimethyl-1-phenylmethoxy-6-phenylsulfanylbicyclo[5.3.1]undec-7-en-3-one
Synonyms:
1-benzyloxy-8,11,11-trimethyl-6-phenylthiobicyclo(5.3.1)undec-7-en-3-one;1-BTPTBU;1-Btptbu;133536-28-4;DTXSID40928178;Bicyclo(5.3.1)undec-7-en-3-one, 8.11.11-trimethyl-1-(phenylmethoxy)-6-(phenylthio)-, (1R*,6S*)-(+-)-;1-(Benzyloxy)-8,11,11-trimethyl-6-(phenylsulfanyl)bicyclo[5.3.1]undec-7-en-3-one;1-Benzyloxy-8,11,11-trimethyl-6-phenylthiobicyclo(5.3.1)undec-7-en-3-one

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(1R,6S)-8,11,11-trimethyl-1-phenylmethoxy-6-phenylsulfanylbicyclo[5.3.1]undec-7-en-3-one Basic Attributes

Molecular Weight：

420.6 g/mol

Exact Mass：

420.21230143 g/mol

Characteristics

PSA：

51.6 Å²

Drug Information

MeSH Entry Terms：

1-benzyloxy-8,11,11-trimethyl-6-phenylthiobicyclo(5.3.1)undec-7-en-3-one

Computed Properties

Molecular Weight:420.6
XLogP3:5.2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:5
Exact Mass:420.21230143
Monoisotopic Mass:420.21230143
Topological Polar Surface Area:51.6
Heavy Atom Count:30
Complexity:639
Defined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of (1R,6S)-8,11,11-trimethyl-1-phenylmethoxy-6-phenylsulfanylbicyclo[5.3.1]undec-7-en-3-one

Basic Attributes
Characteristics
Drug Information
Computed Properties

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