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(6R,7S)-2-BOC-2-AZA-BICYCLO[2.2.1]HEPT-5-EN-3-ONE

(6R,7S)-2-BOC-2-AZA-BICYCLO[2.2.1]HEPT-5-EN-3-ONE structure

CAS No:
151792-53-9
Formula:
C11H15NO3
Chemical Name:
(6R,7S)-2-BOC-2-AZA-BICYCLO[2.2.1]HEPT-5-EN-3-ONE
Synonyms:
(6R,7S)-2-BOC-2-AZA-BICYCLO[2.2.1]HEPT-5-EN-3-ONE;(1R,4S)-tert-butyl 3-oxo-2-aza-bicyclo[2.2.1]hept-5-ene-2-carboxylate;2-Azabicyclo[2.2.1]hept-5-ene-2-carboxylic acid, 3-oxo-,1,1-diMethylethyl ester, (1R,4S)-;tert-butyl (1R,4S)-3-oxo-2-azabicyclo[2.2.1]hept-5-ene-2-carboxylate;racemic-(1R,4S)-tert-butyl 3-oxo-2-azabicyclo[2.2.1]hept-5-ene-2-carboxylate*;(1R,?4S)?-3-?Oxo-2-?azabicyclo[2.2.1]?hept-?5-?ene-?2-?carboxylic acid 1,?1-?Dimethylethyl Ester;(1R,4S)-(-)-2-tert-Butoxycarbonyl-2-azabicyclo[2.2.1]hept-5-en-3-one

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(6R,7S)-2-BOC-2-AZA-BICYCLO[2.2.1]HEPT-5-EN-3-ONE Basic Attributes

Molecular Weight：

209.24

Exact Mass：

209.10519334

DSSTox ID：

DTXSID00474101

Characteristics

Density：

1?+-.0.06 g/cm3

Melting Point：

85.0-86.5 °C

Boiling Point：

339.8±31.0 °C(Predicted)

PKA：

-2.32±0.20

Computed Properties

Molecular Weight:209.24
XLogP3:1.4
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:209.10519334
Monoisotopic Mass:209.10519334
Topological Polar Surface Area:46.6
Heavy Atom Count:15
Complexity:340
Defined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of (6R,7S)-2-BOC-2-AZA-BICYCLO[2.2.1]HEPT-5-EN-3-ONE

Basic Attributes
Characteristics
Computed Properties

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