Valeronitrile
Also known as Pentanenitrile, Butyl cyanide, 1-Cyanobutane
Key facts
What buyers check first
- Physical form
- Liquid
- Melting point
- -96.1 °C
- Boiling point
- 138.9 to 141.1
- Density
- 0.8008 at 68 °F - Less dense than water, will float
- Flash point
- 40.6 °C
- HS code
- 292690
- Category
- Impurities and reference standards
- UN number
- UN 3273

What is Valeronitrile?
Plain description, key identifiers and synonyms
Pentanenitrile is a nitrile.
Identifiers
Registry numbers, names and line notations, tap to copy
- IUPAC name
- pentanenitrile
- CAS number
- 110-59-8 CAS number cross-checked
- EC number
- 203-781-8
- Molecular formula
- C5H9N
- UNII
- X44H3R47D4
- MDL number
- MFCD00001974
- InChIKey
- RFFFKMOABOFIDF-UHFFFAOYSA-N
- InChI
- InChI=1S/C5H9N/c1-2-3-4-5-6/h2-4H2,1H3
- SMILES (canonical and isomeric)
- CCCCC#N
Synonyms
- Pentanenitrile
- Butyl cyanide
- 1-Cyanobutane
- 1-Butyl cyanide
- n-BUTYL CYANIDE
- Pentanonitrile
- n-Pentanenitrile
- Butane, 1-cyano-
- 4-02-00-00875 (Beilstein Handbook Reference)
- Valproic acid impurity h
- Valproic acid impurity h (ep impurity)
- nValeronitrile
- 1Cyanobutane
- 1Butyl cyanide
- Pentanoic acid, nitrile
- n-Valeronitrile
- 1-cyano-butane
- Pentanenitrile (Valeronitrile)
- Pentanenitrile D9
- Valeronitrile, 8CI
- Pentanenitrile, 9CI
- Valeronitrile, 99.5%
- Sodium Valproate Impurity 7
- CH3(CH2)3CN
- Sodium Valproate EP Impurity H, Valproic Acid EP Impurity H
Show all 26 synonymsShow fewer synonyms
- Sodium Valproate Impurity H, <br>Valproic Acid EP Impurity H
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
| Physical form | Liquidexp.Measured value |
|---|---|
| Melting point | -96.1 °Cexp.Measured value |
| Boiling point | 138.9 to 141.1exp.Measured value |
| Density | 0.8008 at 68 °F - Less dense than water, will floatexp.Measured value |
| Flash point | 40.6 °Cexp.Measured value |
| Solubility | 1 to 5 mg/mL at 72.5 °Fexp.Measured value |
| Vapour pressure | 5 mmHg at 64.6 °F, 10 mmHg at 86 °F, 20 mmHg at 109.9 °Fexp.Measured value |
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 | 83.13 g/molcalc.Computed value |
|---|---|
| Exact mass | 83.0735 Dacalc.Computed value |
| LogP (octanol/water) | 1.7calc.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 | 2calc.Computed value |
| Heavy atoms | 6calc.Computed value |
| Rings | 0calc.Computed value |
| Aromatic rings | 0calc.Computed value |
| Fraction sp3 carbons | 0.8calc.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
- H226Flammable liquid and vapour.
- H301Toxic if swallowed.
- H302Harmful if swallowed.
Precautionary statements (18)
- P210Keep away from heat, hot surfaces, sparks, open flames and other ignition sources. No smoking.
- P233Keep container tightly closed.
- P240Ground and bond container and receiving equipment.
- P241Use explosion-proof electrical, ventilating and lighting equipment.
- P242Use non-sparking tools.
- P243Take action to prevent static discharges.
- P264Wash skin thoroughly after handling.
- P270Do not eat, drink or smoke when using this product.
- P280Wear protective gloves, protective clothing, eye protection and face protection.
- P301 + P316If swallowed: Get emergency medical help immediately.
- P301 + P317If swallowed: Get medical help.
- P303 + P361 + P353If on skin (or hair): Take off immediately all contaminated clothing. Rinse skin with water or shower.
- P321Specific treatment (see supplemental first aid instructions on the label).
- P330Rinse mouth.
- P370 + P378In case of fire: Use appropriate media to extinguish.
- P403 + P235Store in a well-ventilated place. Keep cool.
- P405Store locked up.
- P501Dispose of contents and container in accordance with local regulations.
- UN number
- UN 3273
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 aidValeronitrile suppliers
Sponsored listings first, then the documented ranking: membership, verification, replies, completeness, freshness and ratings
- India, Thane ManufacturerUnclaimed profileValeronitrileGrade, purity and minimum order on requestPrice on request
- Germany, Trostberg ManufacturerUnclaimed profileValeronitrileGrade, purity and minimum order on requestPrice on request
- India, SuratUnclaimed profileValeronitrileGrade, purity and minimum order on requestPrice on request
- India, MumbaiUnclaimed profileValeronitrileGrade, purity and minimum order on requestPrice on request
- India, MumbaiUnclaimed profileValeronitrileGrade, purity and minimum order on requestPrice on request
- India ManufacturerUnclaimed profileValeronitrileGrade, purity and minimum order on requestPrice on request
- India, MumbaiUnclaimed profileValeronitrileGrade, purity and minimum order on requestPrice on request
- China ManufacturerUnclaimed profilePentanonitrileGrade, purity and minimum order on requestPrice on request
- India, PuneUnclaimed profileValeronitrileGrade, purity and minimum order on requestPrice on request
- ChinaUnclaimed profileValeronitrileGrade, purity and minimum order on requestPrice on request
Suppliers marked Unclaimed profile have not claimed their profile yet. They are not verified by CompoundList, their offers are price on request and details may have changed, so please confirm them with the supplier. Company representatives can claim a profile with a business email on the company's own website domain. Our team verifies each claim and sends the result by email.
Where suppliers are based
21 suppliers in 6 countries
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Valeronitrile 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
Applications are not documented for this substance yet. Suppliers often describe uses on their product pages, linked in the suppliers list above.
Regulatory status
Inventories, regulations and trade controls that list this substance
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 Valeronitrile 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 Valeronitrile is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.
Frequently asked questions
Quick answers about Valeronitrile, based on the data on this page
What is Valeronitrile?
What is the CAS number of Valeronitrile?
What is the molecular formula and weight of Valeronitrile?
Is Valeronitrile hazardous?
What is the HS code of Valeronitrile?
Where can I buy Valeronitrile?
Where can I buy Valeronitrile in India?
What is the price of Valeronitrile?
Guides for buyers
Practical guides that help when you source, ship or handle Valeronitrile
- Article, QualityPharma grades explained: IP vs BP vs USP vs EPWhat the Indian, British, US and European pharmacopoeias are, how their monographs differ, what multi grade claims mean and why a grade alone does not make a product fit for medicines.Read
- 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, Trade and logisticsShipping dangerous goods: UN numbers, classes and packing groupsHow the UN dangerous goods system works for chemicals, from the nine classes and UN numbers to packing groups, UN packaging marks, labels, documents and segregation.Read
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