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Pellitorine

Pellitorine structure

CAS No:
18836-52-7
Formula:
C14H25NO
Chemical Name:
Pellitorine
Synonyms:
2,4-Decadienamide,N-(2-methylpropyl)-,(2E,4E)-;2,4-Decadienamide,N-isobutyl-,(E,E)-;2,4-Decadienamide,N-(2-methylpropyl)-,(E,E)-;Pellitorine;(2E,4E)-N-(2-Methylpropyl)-2,4-decadienamide;N-Isobutyldeca-trans-2-trans-4-dienamide;N-(2-Methylpropyl)deca-trans-2-trans-4-dienamide;N-Isobutyl-2-trans-4-trans-decadienamide;(E,E)-N-(2-Methylpropyl)-2,4-decadienamide;Pellitorin;trans-Pellitorin;2E,4E-Decadienoic acid N-isobutylamide;(2E,4E)-N-Isobutyl-2,4-decadienamide;trans-Pellitorine;Optaflow A;53608-76-7
Categories:
Natural Products > Alkaloids

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Description

ChEBI: A natural product found in Piper sarmentosum.

Colourless off-white to yellow solid; Spicy herb-type aroma

Pellitorine is a fatty amide. It has a role as a metabolite.

Pellitorine Basic Attributes

Molecular Weight：

223.36

Exact Mass：

223.35

UNII：

8IS5231171

HScode：

2924199090

Characteristics

PSA：

29.1

XLogP3：

3.92

Density：

0.882

Melting Point：

72 °C @ Solvent: Ligroine

Boiling Point：

368.7±15.0 °C at 760 mmHg

Flash Point：

224.6±5.3 °C

Refractive Index：

1.470

Water Solubility：

Insoluble in water|Soluble (in ethanol)

Safety Information

Precautionary statement(s)：

P261, P264, P270, P272, P280, P301+P310, P302+P352, P305+P351+P338, P321, P330, P332+P313, P333+P313, P337+P313, P362, P363, P405, P501

Hazard Statements：

H301

GHS Classification：

|Danger|H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]|P261, P264, P270, P272, P280, P301+P310, P302+P352, P305+P351+P338, P321, P330, P332+P313, P333+P313, P337+P313, P362, P363, P405, and P501|Aggregated GHS information provided by 113 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Drug Information

MeSH Entry Terms：

N-isobutyldeca-trans-2,trans-4-dienamide

Pellitorine Use and Manufacturing

Use Classification：

Food additives -> Flavoring Agents|Flavoring Agents -> JECFA Flavorings Index

Food Additive Classes：

Flavoring Agents

Computed Properties

Molecular Weight:223.35
XLogP3:4.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:8
Exact Mass:223.193614421
Monoisotopic Mass:223.193614421
Topological Polar Surface Area:29.1
Heavy Atom Count:16
Complexity:229
Defined Bond Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Recommended Suppliers of Pellitorine

HANGZHOU LEAP CHEM CO., LTD. Contact Supplier

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Pellitorine

CAS No.: 18836-52-7

Content: 99.00%

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Pellitorine

CAS No.: 18836-52-7

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Guide of Pellitorine

Description
Basic Attributes
Characteristics
Safety Information
Drug Information
Use and Manufacturing
Computed Properties
Recommended Suppliers
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Pellitorine

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