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364428 Sigma-Aldrich

(S)-(−)-Citronellic acid

98%

Synonym: (S)-(−)-3,7-Dimethyl-6-octenoic acid

  • CAS Number 2111-53-7

  • Linear Formula (CH3)2C=CHCH2CH2CH(CH3)CH2CO2H

  • Molecular Weight 170.25

  •  MDL number MFCD00134278

  •  PubChem Substance ID 24862429

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Properties

Related Categories Asymmetric Synthesis, Carboxylic Acids, Cell Biology, Chemical Synthesis, Chiral Building Blocks,
Quality Level   100
assay   98%
optical activity   [α]25/D −8°, neat
refractive index   n20/D 1.453 (lit.)
bp   115-120 °C/0.4 mmHg (lit.)
density   0.926 g/mL at 25 °C (lit.)
SMILES string   C[C@@H](CC\C=C(/C)C)CC(O)=O
InChI   1S/C10H18O2/c1-8(2)5-4-6-9(3)7-10(11)12/h5,9H,4,6-7H2,1-3H3,(H,11,12)/t9-/m0/s1
InChI key   GJWSUKYXUMVMGX-VIFPVBQESA-N

Description

Application

(S)-(-)-Citronellic acid may be used in the synthesis of trisubstituted piperidine substructures of the veratramine and jervine type, that can be building blocks for developing cyclopamine analogs.

Packaging

1 g in glass bottle

Safety & Documentation

Safety Information

Symbol 
GHS07  GHS07
Signal word 
Warning
Hazard statements 
RIDADR 
NONH for all modes of transport
WGK Germany 
WGK 3
Flash Point(F) 
235.4 °F - closed cup
Flash Point(C) 
> 113 °C - closed cup
Protocols & Articles
Peer-Reviewed Papers
15

References

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