3D Mol Similar

1,5-Pentanediol diacrylate

: Iupac Name：5-prop-2-enoyloxypentyl prop-2-enoate; CAS No.: 36840-85-4; Molecular Weight：212.24234; Modify Date.: 2022-11-07 14:50; Introduction:
1,5-Pentanediol diacrylate, with the chemical formula C10H14O4 and CAS registry number 36840-85-4, is a compound used in the production of various polymers and coatings. This colorless liquid, also known as PDDA, is characterized by its two acrylate functional groups. It is commonly used as a crosslinking agent in UV-curable systems, providing improved mechanical properties and adhesion. PDDA is also utilized as a reactive diluent in the formulation of UV-curable inks, adhesives, and coatings. Additionally, it finds applications in the manufacturing of dental materials, optical films, and electronic devices. With its versatile properties, 1,5-Pentanediol diacrylate plays a crucial role in the development of advanced materials for various industries.
View more+

Request For Quotation

1. Names and Identifiers

: 1.1 Name; 1,5-Pentanediol diacrylate; 1.2 Synonyms; 1,1′-(1,5-Pentanediyl) di-2-propenoate 1,5-Pentamethylene Diacrylate 1,5-PENTAMETHYLENE GLYCOL DIACRYLATE 1,5-PENTANEDIOL DIACRYLATE 1,5-Pentanediyl bisacrylate 1,5-pentanediyl diacrylate 2-Propenoic acid, 1,1′-(1,5-pentanediyl) ester 2-Propenoic acid, 1,5-pentanediyl ester Bisacrylic acid pentane-1,5-diyl ester Bispropenoic acid 1,5-pentanediyl Ccris 7043 Einecs 253-235-8 Pentamethylene diacrylate; View all

1.3 CAS No.: 36840-85-4

1.4 CID: 93195

1.5 EINECS(EC#): 253-235-8

1.6 Molecular Formula: C11H16O4 (isomer)

1.7 Inchi: InChI=1S/C11H16O4/c1-3-10(12)14-8-6-5-7-9-15-11(13)4-2/h3-4H,1-2,5-9H2

1.8 InChIkey: XAMCLRBWHRRBCN-UHFFFAOYSA-N

1.9 Canonical Smiles: C=CC(=O)OCCCCCOC(=O)C=C

1.10 Isomers Smiles: C=CC(=O)OCCCCCOC(=O)C=C

2. Properties

2.1 Density: 1.024

2.1 Boiling point: 285.1°Cat760mmHg

2.1 Refractive index: 1.452

2.1 Flash Point: 134.4°C

2.1 Precise Quality: 212.10500

2.1 PSA: 52.60000

2.1 logP: 1.61510

2.1 Chemical Properties: Colorless to pale yellow liquid 1,5-Pentanediol diacrylateSupplier

2.2 Color/Form: Powder

3. Safety and Handling

3.1 Specification: ?? 1,5-Pentanediol diacrylate (CAS No.36840-85-4), its synonyms are 1,5-Pentamethylene glycol diacrylate ; N′,N′-(4,10-dioxa-3,11-dioxo-tridecanylene)-1,13-bis(1,2,3,4-tetrahydroisoquinoline)-bioxalate AND 1,5-Pentamethylene Diacrylate ; Bisacrylic acid pentane-1,5-diyl ester ; Bispropenoic acid 1,5-pentanediyl??.

4. MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

Skin irritation, Category 2

Eye irritation, Category 2

Specific target organ toxicity \u2013 single exposure, Category 3

Hazardous to the aquatic environment, long-term (Chronic) - Category Chronic 2

2.2 GHS label elements, including precautionary statements

Pictogram(s)
Signal word	Warning
Hazard statement(s)	H315 Causes skin irritation H319 Causes serious eye irritation H335 May cause respiratory irritation H411 Toxic to aquatic life with long lasting effects
Precautionary statement(s)
Prevention	P264 Wash ... thoroughly after handling. P280 Wear protective gloves/protective clothing/eye protection/face protection. P261 Avoid breathing dust/fume/gas/mist/vapours/spray. P271 Use only outdoors or in a well-ventilated area. P273 Avoid release to the environment.
Response	P302+P352 IF ON SKIN: Wash with plenty of water/... P321 Specific treatment (see ... on this label). P332+P313 If skin irritation occurs: Get medical advice/attention. P362+P364 Take off contaminated clothing and wash it before reuse. P305+P351+P338 IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing. P337+P313 If eye irritation persists: Get medical advice/attention. P304+P340 IF INHALED: Remove person to fresh air and keep comfortable for breathing. P312 Call a POISON CENTER/doctor/\u2026if you feel unwell. P391 Collect spillage.
Storage	P403+P233 Store in a well-ventilated place. Keep container tightly closed. P405 Store locked up.
Disposal	P501 Dispose of contents/container to ...

2.3 Other hazards which do not result in classification

none

View all

5. NMR Spectrum

13C NMR : Predict

1H NMR : Predict

6. Synthesis Route

36840-85-4Total: 6 Synthesis Route

111-29-5 147 Suppliers

36840-85-4 68 Suppliers

Literatures:
Lee; Kim; Piantadosi; Huang; Geissman Journal of pharmaceutical sciences, 1974 , vol. 63, # 7 p. 1162 - 1163
Yield: null

53219-90-2

36840-85-4 68 Suppliers

Literatures:
Lee; Kim; Piantadosi; Huang; Geissman Journal of pharmaceutical sciences, 1974 , vol. 63, # 7 p. 1162 - 1163
Yield: null

590-92-1 66 Suppliers

111-29-5 147 Suppliers

36840-85-4 68 Suppliers

Literatures:
Burroughs Wellcome Co. Patent: US5453510 A1, 1995 ;
Yield: ~75%

View all

7. Precursor and Product

precursor:

590-92-1

111-29-5

292638-85-8

53219-90-2

814-68-6

product :

64228-84-8

64228-78-0

8. Computational chemical data

Molecular Weight: 212.24234g/mol
Molecular Formula: C₁₁H₁₆O₄
Compound Is Canonicalized: True
XLogP3-AA: 2.3
Exact Mass: 212.10485899
Monoisotopic Mass: 212.10485899
Complexity: 209
Rotatable Bond Count: 10
Hydrogen Bond Donor Count: 0
Hydrogen Bond Acceptor Count: 4
Topological Polar Surface Area: 52.6
Heavy Atom Count: 15
Defined Atom Stereocenter Count: 0
Undefined Atom Stereocenter Count: 0
Defined Bond Stereocenter Count: 0
Undefined Bond Stereocenter Count: 0
Isotope Atom Count: 0
Covalently-Bonded Unit Count: 1
CACTVS Substructure Key Fingerprint: AAADceBwOAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAGgAAAAAACACggAIACAAABACIACDSCAAAAAAAAAAIAAAAAEAABAIAIAACAAAEAAAAIICAIAgAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA==

9. Recommended Suppliers

Global62SuppliersView all >>

Hubei Jiutian Bio-medical Technology Co., Ltd Diamond member

5YRS

Products:electronic chemicals; pharmaceutical intermediates;pesticide intermediates;ultraviolet absorbent; food additives
Tel:86-173-54350817
Email:Ryan@jiutian-bio.com

1,5-Pentanediol diacrylate 36840-85-4 Factory Supply Bisacrylic acid pentane-1,5-diyl ester

Purity:99%Packing: 200kg/bag FOB
Price: 1 USD/kilogram
Time: 2024/09/17

Inquire

Amitychem Corporation Diamond member

4YRS

Products:Manufacture & Supply Biopharm Chemical, Specialty Chemical, PetroChemical.
Tel:86-592-8883942
Email:sale@amitychem.com

Factory Supply Pentamethylene Diacrylate

Purity:99%Packing: 200kg/bag FOB
Price: 0.1 USD/kilogram
Time: 2023/06/28

Inquire

Dayang Chem (Hangzhou) Co., Ltd. Diamond member

13YRS

Products:Chemical products
Tel:86-571-88938639
Email:sales-gc@dycnchem.com

1,5-Pentanediol diacrylate

Purity:99%Packing: 200kg/bag FOB
Price: 3 USD/kilogram
Time: 2024/06/17

Inquire

Henan Tianfu Chemical Co.,Ltd Diamond member

2YRS

Products:Medical Intermediate,Lithium Battery Additive,Organicetc Chemical, Organic Chemical, Paint Chemical and Detergent Chemical etc..
Tel:0086-0371-55170693
Email:info@tianfuchem.com

1,5-Pentanediol diacrylate