Basic information
- CAS
1087-21-4- Standard SMILES
C=CCOC(=O)c1cccc(C(=O)OCC=C)c1- InChIKey
OOORLLSLMPBSPT-UHFFFAOYSA-N- Molecular formula
- C14H14O4
- Average molar mass
- 246.26 g/mol
- Monoisotopic mass
- 246.08920893
Names & identifiers
- Preferred name
- Diallyl isophthalate
- IUPAC
- bis(prop-2-enyl) benzene-1,3-dicarboxylate
- English name
- DIALLYL ISO-PHTHALATE RESIN
- Molecular formula
- C14H14O4
- Molecular weight
- 246.26
Names & synonyms
Diallyl isophthalate1087-21-4Di-2-propenyl isophthalateIsophthalic acid, diallyl ester1,3-Benzenedicarboxylic acid, di-2-propenyl esterDappu 100Dapon MNSC 6098EINECS 214-122-9BRN 2055011AI3-16904Isophthalic acid, di-(2-propenyl) ester
Show more names
POLY(DIALLYL ISOPHTHALATE)daponmdaif-slISO-DAPdappu100ldaisoiso-dapdaipalkyd509daipalkyd510diallylisophthalatepolymerDIALLYL ISO-PHTHALATE RESIN
isophtalic acid, diallyl esterDTXSID7051559Di2propenyl isophthalateRefChem:132592Isophthalic acid, diallyl ester (6CI,7CI,8CI)DTXCID50301111,3Benzenedicarboxylic acid, di2propenyl ester1,3Benzenedicarboxylic acid, 1,3di2propen1yl ester
Database identifiers
- CAS
1087-21-4、25035-78-3- PubChem CID
- 66183
- DTXSID
DTXSID7051559- EC Number
- 214-122-9
- Nikkaji
- J53.657A
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 52.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 8
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 292
Experimental & physicochemical properties
PolymersPlastics & Rubber -> Phthalate Esters
Physical Description
Liquid
Colorless to slightly yellow odorless liquid; [Redox Chemicals MSDS]
Physicochemical properties
- Melting point
- 33 °C · 33 °C
- Density
- 1.256 g/mL · 1.256 g/mL at 25 °C(lit.)
- form
- powder
- EPA Substance Registry System
- 1 · 1,3-Benzenedicarboxylic acid, di-2-propenyl ester, homopolymer (25035-78-3)
- WGK Germany
- 3 · 3
- RTECS
- 4210000 · CZ4210000
- TSCA
- TSCA listed
Safety & regulation
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P272, P273, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P321, P330, P332+P317, P333+P317, P337+P317, P362+P364, P391, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 3 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Regulatory Information
Chemical: 1,3-Benzenedicarboxylic acid, di-2-propenyl ester
1,3-Benzenedicarboxylic acid, 1,3-di-2-propen-1-yl ester is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 1,3-Benzenedicarboxylic acid, 1,3-di-2-propen-1-yl 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: 19-03-2020 https://echa.europa.eu/registration-dossier/-/registered-dossier/22886
Hazards Summary
Intraperitoneal LD50 (mouse) > 62.5 mg/kg; [RTECS] Eye contact causes redness with tears and possibly burns and swelling; May cause delayed skin irritation; Inhalation may cause coughing, dizziness, and collapse; Harmful by ingestion; [Redox Chemicals MSDS] See PHTHALATE ESTERS.
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- wgk
- 3
- tsca
- TSCA listed
- rtecs
- CZ4210000
Chemistry & industry
Uses & manufacturing
UsesUsed for polyester, alkyd, polyurethane, and other high polymers and plasticizers; [Redox Chemicals MSDS]
U.S. Production2023: 87,259 lb
Consumer UsesMonomers
Industry UsesMonomers
General Manufacturing Information
Paint and Coating Manufacturing
1,3-Benzenedicarboxylic acid, 1,3-di-2-propen-1-yl ester: ACTIVE
Suppliers100 total
国药集团化学试剂有限公司86-21-63210123 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
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上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
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Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
武汉绿景丰华生物科技有限公司19972070065 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
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广东云星生物技术有限公司0751-18902340975/189023400307 18902340307 · [email protected]
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TCI Europe320-37350700 · [email protected]
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湖北隆信化工实业有限公司15271551270 · [email protected]
上海将来实业股份有限公司400-0066400 13621662912 · [email protected]
上海马氏化学科技有限公司19916721580 · [email protected]
湖北巨胜科技有限公司027-59599241 18871490274 · [email protected]
九鼎化学（上海）科技有限公司4009209199 · [email protected]
广东翁江化学试剂有限公司0751-2815987 13927875076 · [email protected]
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湖北恒绿源科技有限公司027-88188016 18717196322 · [email protected]
厦门志信化学有限公司+86-5922680277 +86-13806087780 · [email protected]
广东翁江化学试剂有限公司0751-2886766 13927870850 · [email protected]
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河南沃咖斯生物科技有限公司18537671377 · [email protected]
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上海西格生物科技有限公司021-57810052 18930344717 · [email protected]
湖北阡陌生物科技有限公司0711-3812399 18062309155 · [email protected]
湖北齐飞医药化工有限公司027-59322506 18071128681 · [email protected]
武汉克米克生物医药技术有限公司027-13163388153 13163388153 · [email protected]
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广州卡芬生物科技有限公司18029243487 2355327168 · [email protected]
Related reactions
2 records
Compound notes
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