Basic information
- CAS
2589-57-3- Standard SMILES
COC(=O)C(C)(C)N=NC(C)(C)C(=O)OC- InChIKey
ZQMHJBXHRFJKOT-UHFFFAOYSA-N- Molecular formula
- C10H18N2O4
- Average molar mass
- 230.26 g/mol
- Monoisotopic mass
- 230.12665706
Names & identifiers
- Preferred name
- 1,1'-Dimethyl 2,2'-(1,2-diazenediyl)bis(2-methylpropanoate)
- IUPAC
- methyl 2-[(1-methoxy-2-methyl-1-oxopropan-2-yl)diazenyl]-2-methylpropanoate
- English name
- Dimethyl 2,2'-azobis(2-methylpropionate)
- Molecular formula
- C10H18N2O4
- Molecular weight
- 230.26
Names & synonyms
Show more names
Database identifiers
- CAS
2589-57-3- PubChem CID
- 75763
- DTXSID
DTXSID701031497- UNII
- G88X6P053W
- EC Number
- 219-976-6
- Nikkaji
- J117.182H
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 77.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 278
Experimental & physicochemical properties
Physicochemical properties
- Melting point
- 22 · 22-28°C
- Boiling point
- 248.3 · 248.3±25.0 °C(Predicted)
- Density
- 1.06 · 1.06±0.1 g/cm3(Predicted)
- vapor pressure
- 2.85 Pa · 2.85Pa at 20℃
- storage temp.
- 2 · Storage temp. 2-8°C
- Appearance
- White to off-white Solid
- Water Solubility
- insoluble
- InChI
- InChI=1S/C10H18N2O4/c1-9(2,7(13)15-5)11-12-10(3,4)8(14)16-6/h1-6H3
- InChIKey
- ZQMHJBXHRFJKOT-UHFFFAOYSA-N
- SMILES
- N(C(C)(C)C(OC)=O)=NC(C)(C)C(OC)=O
- LogP
- 2.47 at · 2.47 at 25℃
- CAS DataBase Reference
- 2589 · 2589-57-3(CAS DataBase Reference)
- FDA UNII
- 88 X6P053W · G88X6P053W
- Symbol(GHS)
- 2 · GHS02,GHS08,GHS07,GHS09
- Signal word
- Warning
- Hazard statements
- 332 · H332-H242-H319-H302-H373-H400-H317-H341
- Precautionary statements
- 264 · P264-P280-P305+P351+P338-P337+P313P-P261-P271-P304+P340-P312-P201-P202-P281-P308+P313-P405-P501-P210-P220-P234-P280-P370+P378-P403+P235-P411-P420-P501-P273-P391-P501-P261-P272-P280-P302+P352-P333+P313-P321-P363-P501-P264-P270-P301+P312-P330-P501-P260-P314-P501
- TSCA
- TSCA listed
- HS Code
- 29270000 · 29270000
- REACH Registrations
- Active
Safety & regulation
GHS classification
GHS Classification
Danger
H242 (100%): Heating may cause a fire [Danger Self-reactive substances and mixtures; Organic peroxides]
P210, P234, P235, P240, P261, P264, P264+P265, P270, P271, P273, P280, P301+P317, P304+P340, P305+P351+P338, P317, P330, P337+P317, P370+P378, P391, P403, P410, P411, P420, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 112 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Regulatory Information
Propanoic acid, 2,2'-(1,2-diazenediyl)bis[2-methyl-, 1,1'-dimethyl ester is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Propanoic acid, 2,2'-(1,2-diazenediyl)bis[2-methyl-, 1,1'-dimethyl 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)
PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.
Status: Active Update: 30-08-2019 https://echa.europa.eu/registration-dossier/-/registered-dossier/28213
Safety data
- tsca
- TSCA listed
- hs_code
- 29270000
- Signal word
- Warning
- Symbol(GHS)
- GHS02,GHS08,GHS07,GHS09
- Hazard statements
- H332-H242-H319-H302-H373-H400-H317-H341
- REACH Registrations
- Active
- Precautionary statements
- P264-P280-P305+P351+P338-P337+P313P-P261-P271-P304+P340-P312-P201-P202-P281-P308+P313-P405-P501-P210-P220-P234-P280-P370+P378-P403+P235-P411-P420-P501-P273-P391-P501-P261-P272-P280-P302+P352-P333+P313-P321-P363-P501-P264-P270-P301+P312-P330-P501-P260-P314-P501
Chemistry & industry
Uses & manufacturing
General Manufacturing Information
Plastics Material and Resin Manufacturing
Propanoic acid, 2,2'-(1,2-diazenediyl)bis[2-methyl-, 1,1'-dimethyl ester: ACTIVE
Applications
UsesDimethyl 2,2'-azobis(2-methylpropionate) is a nitrile-free, oil-soluble azo polymerization initiator with polymerization activity similar to AIBN. However, it has fewer toxic by-products than AIBN, is safer and can be used as an alternative to AIBN. In addition, the highly volatile decomposition products can be removed during the polymer production process, and the polymer after polymerization is highly transparent, so it is expected to be used in semiconductors and liquid crystal displays(LCDs).
Upstream & downstream products
Downstream products
Suppliers100 total
Related reactions
Compound notes
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