ChemicalBook--->CAS DataBase List--->136-45-8

136-45-8

136-45-8 Structure

136-45-8 Structure
IdentificationMore
[Name]

2,5-PYRIDINEDICARBOXYLIC ACID DI-N-PROPYL ESTER
[CAS]

136-45-8
[Synonyms]

2,5-PYRIDINEDICARBOXYLIC ACID DI-N-PROPYL ESTER
DIISOPROPYL 2,5-PYRIDINDICARBOXYLATE
DI-N-PROPYL 2,5-PYRIDINEDICARBOXYLATE
DI-N-PROPYL ISOCINCHOMERONATE
DIPROPYL ISOCINCHOMERONATE
ISOCINCHOMERONIC ACID DI-N-PROPYL ESTER
MGK 326
MGK 326 (TM)
MGK REPELLENT 326(R)
2,5-pyridinedicarboxylicacid,dipropylester
dipropyl2,5-pyridinedicarboxylate
dipropylesterkyselinypyridin-2,5-dikarboxylove
dipropylpyridine-2,5-dicarboxylate
ent17595
isocinchomeronyldipropylester
mgkr-326
mgkrepellent-326
pyridin-2,5-dicarbonsaeure-di-n-propylester
r-326
repper333
[EINECS(EC#)]

205-245-9
[Molecular Formula]

C13H17NO4
[MDL Number]

MFCD00055315
[Molecular Weight]

251.28
[MOL File]

136-45-8.mol
Chemical PropertiesBack Directory
[Boiling point ]

175 °C / 5mmHg
[density ]

1.12
[refractive index ]

1.4990 to 1.5010
[Fp ]

93.4 °C
[storage temp. ]

0-6°C
[Water Solubility ]

Insoluble in water
[form ]

neat
[pka]

-0.23±0.10(Predicted)
[color ]

Colorless to Yellow to Green
[BRN ]

229600
[Cosmetics Ingredients Functions]

ANTIMICROBIAL
[InChI]

InChI=1S/C13H17NO4/c1-3-7-17-12(15)10-5-6-11(14-9-10)13(16)18-8-4-2/h5-6,9H,3-4,7-8H2,1-2H3
[InChIKey]

IITCWRFYJWUUPC-UHFFFAOYSA-N
[SMILES]

C1(C(OCCC)=O)=NC=C(C(OCCC)=O)C=C1
[LogP]

3.570
[CAS DataBase Reference]

136-45-8(CAS DataBase Reference)
[EPA Substance Registry System]

Dipropyl isocinchomeronate (136-45-8)
Safety DataBack Directory
[RIDADR ]

UN 3082 9 / PGIII
[WGK Germany ]

2
[RTECS ]

US8000000
[HS Code ]

2933.39.9200
[Hazardous Substances Data]

136-45-8(Hazardous Substances Data)
Hazard InformationBack Directory
[General Description]

A solid.
[Production Methods]

Di-n-propyl isocinchomeronate is synthesised through an esterification reaction between isocinchomeronic acid and n-propyl alcohol. The process typically involves heating the acid with an excess of n-propyl alcohol in the presence of an acid catalyst, such as sulphuric acid or p-toluenesulfonic acid, to promote the formation of the ester bond. The reaction mixture is refluxed to ensure complete conversion, and water formed during esterification is removed to drive the reaction forward. After completion, the product is purified through distillation or solvent extraction, yielding di-n-propyl isocinchomeronate.
[Pesticide Type]

Insecticide; Repellent; Veterinary substance
Spectrum DetailBack Directory
[Spectrum Detail]

2,5-PYRIDINEDICARBOXYLIC ACID DI-N-PROPYL ESTER(136-45-8)MS
2,5-PYRIDINEDICARBOXYLIC ACID DI-N-PROPYL ESTER(136-45-8)1HNMR
2,5-PYRIDINEDICARBOXYLIC ACID DI-N-PROPYL ESTER(136-45-8)13CNMR
2,5-PYRIDINEDICARBOXYLIC ACID DI-N-PROPYL ESTER(136-45-8)IR1
Well-known Reagent Company Product InformationBack Directory
[Sigma Aldrich]

136-45-8(sigmaaldrich)
[TCI AMERICA]

Dipropyl 2,5-Pyridinedicarboxylate,>98.0%(GC)(136-45-8)
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