Basic information
- CAS
29590-42-9- Standard SMILES
C=CC(=O)OCCCCCC(C)C- InChIKey
DXPPIEDUBFUSEZ-UHFFFAOYSA-N- Molecular formula
- C11H20O2
- Average molar mass
- 184.27 g/mol
- Monoisotopic mass
- 184.14632988
Names & identifiers
- Preferred name
- Isooctyl acrylate
- IUPAC
- 6-methylheptyl prop-2-enoate
- English name
- ISOOCTYL ACRYLATE
- Molecular formula
- C11H20O2
- Molecular weight
- 184.28
Names & synonyms
ISOOCTYL ACRYLATE29590-42-92-Propenoic acid, isooctyl esterAcrylic acid, isooctyl esterGU1V16S82FDTXSID8027955RefChem:7640249-707-86-Methylheptyl acrylate6-methylheptyl prop-2-enoateIso-octyl acrylate54774-91-3
Show more names
IOAAi3-28217Ccris 4352Isobornyl esterIsooctylacrylatISOCTYLACRYLATEEinecs 249-707-8acrylicacid,isooctylester
isooctylacrylate2-Propenoic acid, 6-methylheptyl esterIsooctyl acrylate monomerMFCD000806022-propenoic acid 6-methylheptyl esterDSSTox_CID_7955DSSTox_RID_78622DSSTox_GSID_27955
Database identifiers
- CAS
29590-42-9、54774-91-3- PubChem CID
- 165746
- DTXSID
DTXSID00274047- ChEMBL
CHEMBL1877930- UNII
- GU1V16S82F
- EC Number
- 249-707-8
- Nikkaji
- J99.451K
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 8
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 150
Experimental & physicochemical properties
LogP3.93
Density
0.9 g/cm³
Relative density of the vapour/air-mixture at 20 °C (air = 1): 1.01
Viscosity2 mm²/s at 25 °C
SolubilitySolubility in water, g/100ml at 23 °C: 0.001 (very poor)
Flash Point
91 °C
91 °C c.c.
Boiling Point196.8 °C
Vapor DensityRelative vapor density (air = 1): 6.4
Vapor Pressure
0.15 [mmHg]
Vapor pressure, Pa at 25 °C: 133.3
Physical Description
Liquid; CBI
Colorless liquid; [CHEMINFO]
COLOURLESS LIQUID.
Kovats Retention Index
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H315: Causes skin irritation [Warning Skin corrosion/irritation]；H319: Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335: May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]；H400: Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard]；H410: Very toxic to aquatic life with long lasting effects [Warning Hazardous to the aquatic environment, long-term hazard]
P261, P264, P264+P265, P271, P273, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P391, P403+P233, P405, and P501 (click each P-code to see the statement)
Warning
Hazard information
Regulatory Information
Chemical: 2-Propenoic acid, isooctyl ester
2-Propenoic acid, isooctyl ester is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 2-Propenoic acid, isooctyl 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)
Status: Active Update: 20-07-2020 https://echa.europa.eu/registration-dossier/-/registered-dossier/2087
Isooctyl acrylate: Does not have an individual approval but may be used under an appropriate group standard
Fire HazardsCombustible. Above 91 °C explosive vapour/air mixtures may be formed.
Hazards Summary
A skin, eye, and respiratory tract irritant; [eChemPortal: ESIS] Skin irritation reported in workers; No skin sensitization detected in animal studies; [AIHA] An irritant and lachrymator; May cause skin sensitization; [MSDSonline] See ACRYLIC RESINS (MONOMERS).
Chemistry & industry
Uses & manufacturing
UsesUsed as a concrete sealer polymerized at the job site and to make other acrylic polymers; [eChemPortal: SIDSUNEP] Used to make hypoallergenic skin adhesives in medical applications; [AIHA]
U.S. Production2023: 50,000,000 - <100,000,000 lb；2022: 50,000,000 - <100,000,000 lb；2021: 50,000,000 - <100,000,000 lb；2020: 50,000,000 - <100,000,000 lb
Consumer UsesMonomers
Industry UsesMonomers；Binder；Photosensitive chemicals
General Manufacturing Information
Electrical Equipment, Appliance, and Component Manufacturing；Adhesive Manufacturing；Other (requires additional information)；Miscellaneous Manufacturing
2-Propenoic acid, isooctyl ester: ACTIVE
Applications
UsesIsooctyl acrylate may be used to prepare linear copolymers with cinnamoyloxyethyl methacrylate (CEMA) for applications as oil absorbents. Copolymer of isooctyl acrylate /acrylamine (1:1 mole ratio) was studied as a magnetoelastic CO2 sensor With high sensitivity. Isooctyl acrylate (IOA) based copolymers may be used to prepare pressure-sensitive acrylic medical grade adhesives for skin.
General DescriptionThe structure of Isooctyl acrylate consists of eight carbon alkyl esters of acrylic acid.
Suppliers83 total
山东旭晨化工科技有限公司0533-15715337262 15715337262 · [email protected]
Shandong chuangyingchemical Co., Ltd.18853181302 · [email protected]
Related reactions
65 records
Compound notes
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