Basic information
- CAS
2449-10-7- Standard SMILES
CCCCCCOC(=O)CCCCCCCCC(=O)OCCCCCC- InChIKey
GQIDSVPVVYHXAP-UHFFFAOYSA-N- Molecular formula
- C22H42O4
- Average molar mass
- 370.6 g/mol
- Monoisotopic mass
- 370.30830982
Names & identifiers
- Preferred name
- Dihexyl sebacate
- IUPAC
- dihexyl decanedioate
- English name
- dihexyl sebacate
- Molecular formula
- C22H42O4
- Molecular weight
- 370.57
Names & synonyms
Dihexyl sebacatedihexyl decanedioate2449-10-71,10-DIHEXYL DECANEDIOATEDecanedioic acid, dihexyl esterMFCD00368178Di-n-hexyl sebacateDECANEDIOIC ACID DIHEXYL ESTERSCHEMBL305076DTXSID10179251EINECS 219-509-6AKOS037645061
Show more names
decyldiacidihexyl esterDecanedioic acid, 1,10-dihexyl ester
AS-56717NS00047726D93410F844072Q63393553
Database identifiers
- CAS
2449-10-7- PubChem CID
- 75558
- DTXSID
DTXSID10179251- EC Number
- 219-509-6
- Nikkaji
- J47.365K
Properties
Computed structural properties
- XLogP
- 7.4
- Topological polar surface area
- 52.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 21
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 296
Physicochemical properties
- Melting point
- 0.85 °C · 0.85°C
- Boiling point
- 420.44 °C · 420.44°C (rough estimate)
- Density
- 0.9733 · 0.9733 (rough estimate)
- refractive index
- 1.4433 · 1.4433 (estimate)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers13 total
上海腾准生物科技有限公司19821570922 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
湖北兴琰新材料科技有限公司13129948835 · [email protected]
荆州市尹杰化工有限公司18008658728 · [email protected]
安阳鸿蒙新材料有限公司19588588067 · [email protected]
江苏艾康生物医药研发有限公司025-66113011 19370895928 · [email protected]
湖南秉航新材料有限公司85521272 18932438858 · [email protected]
陕西缔都医药化工有限公司029-029-029-81148696 18161915376 · [email protected]
武汉福鑫化工有限公司027-59207852 13308628970 · [email protected]
上海凯为化学科技有限公司021-58461859 15821823057 · [email protected]
武汉浩荣生物科技有限公司13217229939 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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