Bis(2-butoxyethyl) sebacate
Basic information
- CAS
141-19-5- Standard SMILES
CCCCOCCOC(=O)CCCCCCCCC(=O)OCCOCCCC- InChIKey
KZBSIGKPGIZQJQ-UHFFFAOYSA-N- Molecular formula
- C22H42O6
- Average molar mass
- 402.6 g/mol
- Monoisotopic mass
- 402.29813906
Names & identifiers
- Preferred name
- Bis(2-butoxyethyl) sebacate
- IUPAC
- bis(2-butoxyethyl) decanedioate
- English name
- Bis(2-butoxyethyl) sebacate
- Molecular formula
- C22H42O6
- Molecular weight
- 402.57
Names & synonyms
Bis(2-butoxyethyl) sebacate141-19-5bis(2-butoxyethyl) decanedioateDecanedioic acid, bis(2-butoxyethyl) esterDecanedioic acid, 1,10-bis(2-butoxyethyl) esterDTXSID60448029D0TU0RR8ZEINECS 205-467-6AI3-03528DTXCID4024802SEBACIC ACID, BIS(2-BUTOXYETHYL) ESTERDI(ETHYLENE GLYCOL BUTYL ETHER) SEBACATE
Show more names
Staflex DBESHallco C 504Plasthall 207Plasthall DBESBIS(2-BUTOXYETHYL) SEBACATE, TECH.Sebacicacidbis(2-butoxyethyl)esterDecanedioicacid,bis(2-butoxyethyl)ester
RefChem:568697205-467-6Dibutyoxyethyl sebacateDIBUTOXYETHYL SEBACATEUNII-9D0TU0RR8Zdi(Butoxyethyl) sebacateBis(2-n-butoxyethyl)sebacateSCHEMBL716515
Database identifiers
- CAS
141-19-5- PubChem CID
- 67329
- DTXSID
DTXSID6044802- ChEMBL
CHEMBL3561119- UNII
- 9D0TU0RR8Z
- EC Number
- 205-467-6
- Nikkaji
- J45.486I
Properties
Computed structural properties
- XLogP
- 5
- Topological polar surface area
- 71.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 23
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 325
Experimental & physicochemical properties
Physical DescriptionLiquid
Collision Cross Section197.8 Ų [M+Na]+ [CCS Type: DT; Buffer gas: N2; Ionization: ESI+; Dataset: TOXCAST; Source Identifier: DTXSID6044802]
Physicochemical properties
- Boiling point
- 238 · 238-240 °C(Press: 5 Torr)
- Density
- 0.971 g/mL · 0.971 g/mL at 25 °C(lit.)
- refractive index
- 20 · n20/D 1.447(lit.)
- Flash point
- 113 °C · 113 °C
- FDA UNII
- 9 D0TU0RR8Z · 9D0TU0RR8Z
- EPA Substance Registry System
- Decanedioic acid, bis(2-butoxyethyl) ester (141-19-5)
- TSCA
- TSCA listed
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 ClassificationNot Classified
Hazard information
Regulatory Information
Decanedioic acid, 1,10-bis(2-butoxyethyl) ester is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Decanedioic acid, 1,10-bis(2-butoxyethyl) 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)
Hazard Classes and CategoriesNot Classified
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
U.S. Production2023: <75,000 lb
Consumer UsesPlasticizer
Industry UsesPlasticizer
General Manufacturing Information
Rubber Product Manufacturing
Decanedioic acid, 1,10-bis(2-butoxyethyl) ester: ACTIVE
Suppliers
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Related reactions
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Compound notes
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