Geranyl nitrile
Also known as citronitrile, Citralva, 3,7-Dimethyl-2,6-octadienenitrile
Key facts
What buyers check first
- CAS number
- 5146-66-7
- Formula
- C10H15N
- Molar mass
- 149.24 g/mol
- EC number
- 225-918-0
- HS code
- 292690
- Category
- Nitriles, nitro and azo compounds
What is Geranyl nitrile?
Plain description, key identifiers and synonyms
Geranyl nitrile is a chemical substance with the molecular formula C10H15N and a molar mass of 149.24 g/mol. Its CAS registry number is 5146-66-7. The IUPAC name is 3,7-dimethylocta-2,6-dienenitrile.
Identifiers
Registry numbers, names and line notations, tap to copy
- IUPAC name
- 3,7-dimethylocta-2,6-dienenitrile
- CAS number
- 5146-66-7 CAS number cross-checked
- EC number
- 225-918-0
- Molecular formula
- C10H15N
- InChIKey
- HLCSDJLATUNSSI-UHFFFAOYSA-N
- InChI
- InChI=1S/C10H15N/c1-9(2)5-4-6-10(3)7-8-11/h5,7H,4,6H2,1-3H3
- SMILES (canonical and isomeric)
- CC(=CCCC(=CC#N)C)C
Synonyms
- citronitrile
- Citralva
- 3,7-Dimethyl-2,6-octadienenitrile
- 2,6-Octadienenitrile, 3,7-dimethyl-
- 3,7-Dimethylocta-2,6-dienenitrile
- Geranyl nitrile [mixture of (E)- and (Z)- isomers, (1:1)]
Physical and chemical properties
Measured values and descriptors computed from the structure
Physical and chemical properties
Measured values, check the supplier specification for your grade
No measured properties are recorded for this substance yet. Ask suppliers for a technical data sheet.
Values vary by grade. Ask suppliers for the COA or TDS of the batch you buy.
Computed descriptors
Calculated from the structure, useful for screening and formulation
| Molecular weight | 149.24 g/molcalc.Computed value |
|---|---|
| Exact mass | 149.1204 Dacalc.Computed value |
| LogP (octanol/water) | 3.2calc.Computed value |
| Topological polar surface area | 23.79 Ųcalc.Computed value |
| Hydrogen bond donors | 0calc.Computed value |
| Hydrogen bond acceptors | 1calc.Computed value |
| Rotatable bonds | 3calc.Computed value |
| Heavy atoms | 11calc.Computed value |
| Rings | 0calc.Computed value |
| Aromatic rings | 0calc.Computed value |
| Fraction sp3 carbons | 0.5calc.Computed value |
| Formal charge | 0calc.Computed value |
| Stereocentres | 0calc.Computed value |
| Lipinski rule of five | Passes (0 violations)calc.Computed value |
Calculated for screening. Confirm critical figures with the supplier.
Safety and hazards
GHS classification summary, not a safety data sheet
Hazard statements
- H340May cause genetic defects.
Precautionary statements (5)
- P203Obtain, read and follow all safety instructions before use.
- P280Wear protective gloves, protective clothing, eye protection and face protection.
- P318If exposed or concerned, get medical advice.
- P405Store locked up.
- P501Dispose of contents and container in accordance with local regulations.
GHS classification summary, not a safety data sheet (SDS). Classifications can differ by supplier, grade and concentration. Always check the supplier's SDS.
Full safety data and first aidGeranyl nitrile suppliers
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- India, MumbaiUnclaimed profileGeranyl nitrileGrade, purity and minimum order on requestPrice on request
- India ManufacturerUnclaimed profileGeranyl nitrileGrade, purity and minimum order on requestPrice on request
- India, MumbaiUnclaimed profileGeranyl nitrileGrade, purity and minimum order on requestPrice on request
- China, TianjinUnclaimed profileGeranyl nitrileGrade, purity and minimum order on requestPrice on request
- Price on request
- India ManufacturerUnclaimed profileGeranyl nitrileGrade, purity and minimum order on requestPrice on request
- Haiti, Port au Prince ManufacturerUnclaimed profileGeranyl nitrileGrade, purity and minimum order on requestPrice on request
- Italy, Vimercate ManufacturerUnclaimed profileCitronitrileGrade, purity and minimum order on requestPrice on request
- India, MumbaiUnclaimed profileGeranyl nitrileGrade, purity and minimum order on requestPrice on request
- United StatesUnclaimed profileGeranyl nitrileGrade, purity and minimum order on requestPrice on request
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Where suppliers are based
12 suppliers in 7 countries
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Geranyl nitrile price
Indicative price range per kg from live supplier offers
Suppliers quote this chemical on request. Send one free request and compare quotes side by side.
Uses and applications
What the substance is used for, by industry and function
Industries and functions
Functional uses
- Flavouring and nutrient
Regulatory status
Inventories, regulations and trade controls that list this substance
Europe
- EU harmonised classification (CLP Annex VI)Index no: 608-067-00-3
Health and food
- EU Cosmetics Regulation Annex II, prohibited in cosmeticsName: 3,7-Dimethylocta-2,6- dienenitrile, Ref no: 1638, Annex ref: II/1638
United States
- TSCA inventory (USA)Status: Active in US commerce
HS code and trade data
Customs classification and reported world trade statistics
Global trade
World import and export statistics for the HS code Geranyl nitrile is traded under.
Nitrile-function compounds, other
- United States13.6%
- China12.4%
- Brazil11.9%
* Partner reported figures, a lower bound.
The HS code shown for Geranyl nitrile is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.
Frequently asked questions
Quick answers about Geranyl nitrile, based on the data on this page
What is Geranyl nitrile?
What is the CAS number of Geranyl nitrile?
What is the molecular formula and weight of Geranyl nitrile?
What is Geranyl nitrile used for?
Is Geranyl nitrile hazardous?
What is the HS code of Geranyl nitrile?
Where can I buy Geranyl nitrile?
Where can I buy Geranyl nitrile in India?
What is the price of Geranyl nitrile?
Guides for buyers
Practical guides that help when you source, ship or handle Geranyl nitrile
- Guide, SafetyHow to read a safety data sheet in 10 minutesA section by section method to pull the essentials out of any 16 section SDS: identity, hazards, composition, storage, PPE, properties, transport and emergency measures.Read
- Guide, SafetyGHS pictograms, signal words and hazard statements explainedA practical guide to the nine GHS pictograms, the signal words Danger and Warning, H and P statements, and how to read a chemical label in seconds.Read
- Article, SourcingHow to write an RFQ that gets fast and accurate quotesWhat suppliers need to quote quickly and comparably: exact product identity, quantity and packing, delivery terms, documents, samples and payment, with a ready to use template.Read
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