Cyclohexanepropanoic acid
Also known as 3-Cyclohexylpropanoic acid, Cyclohexanepropionic acid, 3-Cyclohexylpropionic acid
Key facts
What buyers check first
- CAS number
- 701-97-3
- Formula
- C9H16O2
- Molar mass
- 156.23 g/mol
- EC number
- 211-861-9
- HS code
- 291620
- Category
- Carboxylic acids and anhydrides
What is Cyclohexanepropanoic acid?
Plain description, key identifiers and synonyms
Cyclohexanepropanoic acid is a chemical substance with the molecular formula C9H16O2 and a molar mass of 156.23 g/mol. Its CAS registry number is 701-97-3. The IUPAC name is 3-cyclohexylpropanoic acid.
Identifiers
Registry numbers, names and line notations, tap to copy
- IUPAC name
- 3-cyclohexylpropanoic acid
- CAS number
- 701-97-3 CAS number cross-checked
- EC number
- 211-861-9
- Molecular formula
- C9H16O2
- UNII
- U36W9HNV6D
- MDL number
- MFCD00001527
- InChIKey
- HJZLEGIHUQOJBA-UHFFFAOYSA-N
- InChI
- InChI=1S/C9H16O2/c10-9(11)7-6-8-4-2-1-3-5-8/h8H,1-7H2,(H,10,11)
- SMILES (canonical and isomeric)
- C1CCC(CC1)CCC(=O)O
Synonyms
- 3-Cyclohexylpropanoic acid
- Cyclohexanepropionic acid
- 3-Cyclohexylpropionic acid
- Cyclohexylpropionic acid
- 3-cyclohexanepropanoic acid
- beta-Cyclohexylpropionic acid
- Cyclohexanepropionic acid (8CI)
- 3-Cyclohexanepropionic acid
- Cyclohexane propionic acid
- 3-cyclohexyl-propionic acid
- 3-cyclohexyl propionic acid
- CXP
- 3-CyclohexylpropionicAcid
- Cyclohexanepropi
- 2ay2
- Cyclohexane-propionic acid
- cyclohexylethylcarboxylic acid
- 3-Cyclohexanepropionic acid, 99%
- 3-Cyclohexanepropionic acid Solution in Acetonitrile, 1000ug/mL
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 | 156.23 g/molcalc.Computed value |
|---|---|
| Exact mass | 156.115 Dacalc.Computed value |
| LogP (octanol/water) | 2.43calc.Computed value |
| Topological polar surface area | 37.3 Ųcalc.Computed value |
| Hydrogen bond donors | 1calc.Computed value |
| Hydrogen bond acceptors | 1calc.Computed value |
| Rotatable bonds | 3calc.Computed value |
| Heavy atoms | 11calc.Computed value |
| Rings | 1calc.Computed value |
| Aromatic rings | 0calc.Computed value |
| Fraction sp3 carbons | 0.89calc.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.
Murcko scaffold
The ring system that remains when every side chain is removed
Safety and hazards
GHS classification summary, not a safety data sheet
Hazard statements
- H302Harmful if swallowed.
- H315Causes skin irritation.
- H319Causes serious eye irritation.
- H335May cause respiratory irritation.
Precautionary statements (19)
- P261Avoid breathing dust, fume, gas, mist, vapours or spray.
- P264Wash skin thoroughly after handling.
- P264 + P265Wash skin thoroughly after handling. Do not touch eyes.
- P270Do not eat, drink or smoke when using this product.
- P271Use only outdoors or in a well-ventilated area.
- P280Wear protective gloves, protective clothing, eye protection and face protection.
- P301 + P317If swallowed: Get medical help.
- P302 + P352If on skin: Wash with plenty of water.
- P304 + P340If inhaled: Remove person to fresh air and keep comfortable for breathing.
- P305 + P351 + P338If in eyes: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.
- P319Get medical help if you feel unwell.
- P321Specific treatment (see supplemental first aid instructions on the label).
- P330Rinse mouth.
- P332 + P317If skin irritation occurs: Get medical help.
- P337 + P317If eye irritation persists: Get medical help.
- P362 + P364Take off contaminated clothing. And wash it before reuse.
- P403 + P233Store in a well-ventilated place. Keep container tightly closed.
- 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 aidCyclohexanepropanoic acid suppliers
Sponsored listings first, then the documented ranking: membership, verification, replies, completeness, freshness and ratings
- India, Nashik ManufacturerUnclaimed profileCyclohexanepropanoic acidGrade, purity and minimum order on requestPrice on request
- China, BeijingUnclaimed profileCyclohexanepropanoic acidGrade, purity and minimum order on requestPrice on request
- China, TaizhouUnclaimed profileCyclohexanepropanoic acidGrade, purity and minimum order on requestPrice on request
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Cyclohexanepropanoic acid 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
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 Cyclohexanepropanoic acid is traded under.
Cyclanic, cyclenic or cycloterpenic monocarboxylic acids, their anhydrides, halides…
- Brazil20.3%
- United States15.7%
- India * partner reported12.8%
* Partner reported figures, a lower bound.
The HS code shown for Cyclohexanepropanoic acid is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.
Frequently asked questions
Quick answers about Cyclohexanepropanoic acid, based on the data on this page
What is Cyclohexanepropanoic acid?
What is the CAS number of Cyclohexanepropanoic acid?
What is the molecular formula and weight of Cyclohexanepropanoic acid?
What is Cyclohexanepropanoic acid used for?
Is Cyclohexanepropanoic acid hazardous?
What is the HS code of Cyclohexanepropanoic acid?
Where can I buy Cyclohexanepropanoic acid?
Where can I buy Cyclohexanepropanoic acid in India?
What is the price of Cyclohexanepropanoic acid?
Guides for buyers
Practical guides that help when you source, ship or handle Cyclohexanepropanoic acid
- 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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