CAS 3066-71-5 Cyclohexyl acrylate (HCID 18298)

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Basic information

CAS: 3066-71-5
Standard SMILES: C=CC(=O)OC1CCCCC1
InChIKey: KBLWLMPSVYBVDK-UHFFFAOYSA-N
Molecular formula: C9H14O2
Average molar mass: 154.21 g/mol
Monoisotopic mass: 154.09937969

Names & identifiers

Preferred name: Cyclohexyl acrylate
IUPAC: cyclohexyl prop-2-enoate
English name: Cyclohexyl acrylate
Molecular formula: C9H14O2
Molecular weight: 154.21

Names & synonyms

Cyclohexyl acrylate3066-71-52-Propenoic acid, cyclohexyl esterSartomer SR 220ACRYLIC ACID, CYCLOHEXYL ESTERSR 220EINECS 221-319-3NSC 18612BRN 1937528AI3-03839NSC-1861225B347Q26U

Show more names

ACRYLIC ACID CYCLOHEXYL ESTERsr220sartomersr2202-Cyclohexyl acrylateCHLUMICRYI CHA MonomerAcrylic acid cyclohexyl

CYCLOHEXYL 2-PROPENOATEDTXSID20222044-06-00-00038 (Beilstein Handbook Reference)RefChem:580804DTXCID2022042Propenoic acid, cyclohexyl ester221-319-3cyclohexyl prop-2-enoate

Database identifiers

CAS: 3066-71-5
PubChem CID: 18298
DTXSID: DTXSID2022204
UNII: 25B347Q26U
EC Number: 221-319-3
Nikkaji: J12.881C

Properties

Computed structural properties

XLogP: 2.5
Topological polar surface area: 26.3 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 2
Rotatable bonds: 3
Heavy atoms: 11
Formal charge: 0
Complexity: 146

Experimental & physicochemical properties

PolymersPlastics & Rubber -> (Meth)acrylates

SpringerMaterials PropertiesOptical coefficient

Physical DescriptionLiquid; [Alfa Aesar MSDS]

Physicochemical properties

Boiling point: 182 · 182-184°C
Density: 0 · 0,975 g/cm3
refractive index: 1.46 · 1.4600
Flash point: 68 °C · 68°C
storage temp.: 2 · 2-8°C, stored under nitrogen
form: clear liquid
color: Colorless to Almost colorless
Viscosity: 8 cp · 8cp (25C)
BRN: 1937528 · 1937528
InChI: InChI=1S/C9H14O2/c1-2-9(10)11-8-6-4-3-5-7-8/h2,8H,1,3-7H2
InChIKey

Safety & regulation

GHS classification

GHS Classification · 6 items

Warning

H315: Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P271, P273, P280, P302+P352, P304+P340, P319, P321, P332+P317, P362+P364, P391, P403+P233, P405, and P501 (click each P-code to see the statement)

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P271, P273, P280, P302+P352, P304+P340, P319, P321, P332+P317, P362+P364, P391, P403+P233, P405, and P501 (click each P-code to see the statement)

Hazard information

Regulatory Information · 2 items

Chemical: 2-Propenoic acid, cyclohexyl ester

2-Propenoic acid, cyclohexyl ester is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 2-Propenoic acid, cyclohexyl ester are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)

Hazards SummaryOral LD50 (rat) = 8,980 uL/kg; Dermal LD50 (rabbit) = 2,520 uL/kg; [RTECS] Stabilized with 4-methoxyphenol (CAS# 150-76-5); An irritant; [Alfa Aesar MSDS] See Cyclohexyl methacrylate.

Hazard Classes and Categories · 3 items

Skin Irrit. 2 (100%)

Specific target organ toxicity (single exposure) - category 3

STOT SE 3

Toxicology

Adverse EffectsSkin Sensitizer - An agent that can induce an allergic reaction in the skin.

Safety data

tsca: TSCA listed
rtecs: AS7350000

Chemistry & industry

Uses & manufacturing

U.S. Production2023: <50,000 lb

Industry UsesMonomers

General Manufacturing Information · 2 items

Paint and Coating Manufacturing

2-Propenoic acid, cyclohexyl ester: ACTIVE

Applications · 1 item

UsesCyclohexyl acrylate is commonly used in industrial and scientific laboratory research. Examples include phase behaviour studies of binary and ternary mixtures of poly(cyclohexyl acrylate) and poly(cyclohexyl methacrylate) in supercritical CO2[1]. As well as kinetic modelling studies of the ester exchange reaction between cyclohexyl acrylate and n-butanol[2], and so on.