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Tropinone

Tropinone structure

CAS No:
532-24-1
Formula:
C8H13NO
Chemical Name:
Tropinone
Synonyms:
8-Azabicyclo[3.2.1]octan-3-one,8-methyl-;1αH,5αH-Tropan-3-one;Tropinone;Tropanone;8-Methyl-8-azabicyclo[3.2.1]octan-3-one;3-Tropanone;3-Tropinone;Tropanon;Tropinon;N-Methyl-8-azabicyclo[3.2.1]octan-3-one;NSC 118012;25866-00-6;35193-79-4;1207071-38-2
Categories:
Chemical Reagents > Organic Reagents

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Description

Tropinone, an alkaloid, acts as a synthetic intermediate to Atropine[1].

Tropinone Basic Attributes

Molecular Weight：

139.19

Exact Mass：

139.19

BRN：

2329

EC Number：

208-530-6

NSC Number：

118012

HScode：

29399990

Characteristics

PSA：

20.3

XLogP3：

0.3

Appearance：

brown crystalline

Density：

1.1±0.1 g/cm3

Melting Point：

43 °C

Boiling Point：

227 °C

Flash Point：

194 °F

Refractive Index：

1.505

Storage Conditions：

2-8°C

Safety Information

Packing level：

III

Hazard category：

6.1

Transport codes：

1544

wgk germany：

hazard class code：

34-22-36/37/38

safety instructions：

23-24/25-36/37/39-26-22

Marks：

C,Xi

Precautionary statement(s)：

P260, P264, P270, P280, P301+P312, P301+P330+P331, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P330, P332+P313, P337+P313, P362, P363, P405, P501

Hazard Statements：

H302

Drug Information

MeSH Entry Terms：

3-tropinone

Tropinone Use and Manufacturing

Methods of Manufacturing

It is prepared by heating succinic aldehyde with methylamine and acetone dicarboxylic acid under alkaline conditions.

Uses

Tropinone is an oxidative product of Tropane, used to synthesize Morphine and Tropane alkaloids.

Manufacturing Info：

8-Azabicyclo[3.2.1]octan-3-one, 8-methyl-: ACTIVE|PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.

Computed Properties

Molecular Weight:139.19
XLogP3:0.3
Hydrogen Bond Acceptor Count:2
Exact Mass:139.099714038
Monoisotopic Mass:139.099714038
Topological Polar Surface Area:20.3
Heavy Atom Count:10
Complexity:151
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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