Basic information
- CAS
16754-49-7- Standard SMILES
CC(C)COC(OCC(C)C)OCC(C)C- InChIKey
IVXPLWROXBUJSE-UHFFFAOYSA-N- Molecular formula
- C13H28O3
- Average molar mass
- 232.36 g/mol
- Monoisotopic mass
- 232.20384475
Names & identifiers
- Preferred name
- Propane, 1,1',1''-[methylidynetris(oxy)]tris[2-methyl-
- IUPAC
- 1-[bis(2-methylpropoxy)methoxy]-2-methylpropane
- English name
- Orthoformic acid triisobutyl ester
- Molecular formula
- C13H28O3
- Molecular weight
- 232.36
Names & synonyms
16754-49-7Propane, 1,1',1''-[methylidynetris(oxy)]tris[2-methyl-triisobutyl orthoformate1-[bis(2-methylpropoxy)methoxy]-2-methylpropaneOrthoformic acid, triisobutyl estertriisobutoxy-methaneSCHEMBL1495313DTXSID50337898IVXPLWROXBUJSE-UHFFFAOYSA-NMFCD31556131AKOS0376465511-(diisobutoxymethoxy)-2-methyl-propane
Show more names
Orthoformic acid triisobutyl ester1,1',1''-(Methylidynetrisoxy)tri(2-methylpropane)
1-(Diisobutoxymethoxy)-2-methylpropane #AS-69502S11866F795200Propane,1,1',1''-[methylidynetris(oxy)]tris[2-methyl-Propane, 1,1',1''-[methylidynetris(oxy)]-tris(2-methyl)-
Database identifiers
- CAS
16754-49-7- PubChem CID
- 545394
- DTXSID
DTXSID50337898- Nikkaji
- J122.389E
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 27.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 9
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 127
Experimental & physicochemical properties
SpringerMaterials PropertiesOptical coefficient
Physicochemical properties
- Boiling point
- 314.53 °C · 314.53°C (rough estimate)
- Density
- 0.8582 · 0.8582
- refractive index
- 1.412 · 1.4120 (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
Downstream products
Suppliers9 total
常州金和生物科技有限公司18796930758 · [email protected]
烟台正信新材料科技有限公司13854547682 13854547682 · [email protected]
武汉泰凯塞科技有限公司027-86697669 13986148687 · [email protected]
上海敏寒医药科技有限公司17612188245 · [email protected]
武汉德拜技术有限公司18086626237 18086626237 · [email protected]
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +86-15355479329 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 15955137747 · [email protected]
上海凯为化学科技有限公司021-58461859 15821823057 · [email protected]
上海相辉医药科技有限公司13611835272 13611835272 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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