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Indicine

Indicine structure

Indicine 

structure
  • CAS No:

    480-82-0

  • Formula:

    C15H25NO5

  • Chemical Name:

    Indicine

  • Synonyms:

    Butanoic acid,2,3-dihydroxy-2-(1-methylethyl)-,[(1R,7aR)-2,3,5,7a-tetrahydro-1-hydroxy-1H-pyrrolizin-7-yl]methyl ester,(2R,3S)-;Indicine;Butanoic acid,2,3-dihydroxy-2-(1-methylethyl)-,(2,3,5,7a-tetrahydro-1-hydroxy-1H-pyrrolizin-7-yl)methyl ester,[1R-[1α,7(2R*,3S*),7aβ]]-;(+)-Indicine;Retronecine,7-[(2R,3S)-2,3-dihydroxy-2-isopropylbutyrate];NSC 136052

  • Categories:

    Organic Chemistry  >  Heterocyclic Ring

Description

Indicine is a member of pyrrolizines and a carboxylic ester.

Indicine Basic Attributes

299.36300

299.36

T82SFG1584

136052

DTXSID60197389

Characteristics

90.23000

-0.4

1.26g/cm3

97-98 °C

463.3ºC at 760 mmHg

234ºC

1.567

1.57E-10mmHg at 25°C

Drug Information

echinatine

Computed Properties

Molecular Weight:299.36
XLogP3:-0.4
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:6
Exact Mass:299.17327290
Monoisotopic Mass:299.17327290
Topological Polar Surface Area:90.2
Heavy Atom Count:21
Complexity:436
Defined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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    CAS No.: 480-82-0
    Grade: Industrial Grade
    Content: 99%
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