Basic information
- CAS
2490-19-9- Standard SMILES
CCCCCCCCC(C)CCCCCCCCC(=O)OC- InChIKey
ATERKICZYCBQCQ-UHFFFAOYSA-N- Molecular formula
- C20H40O2
- Average molar mass
- 312.5 g/mol
- Monoisotopic mass
- 312.30283051
Names & identifiers
- Preferred name
- Methyl 10-methyloctadecanoate
- IUPAC
- methyl 10-methyloctadecanoate
- English name
- Methyl tuberuculostearate
- Molecular formula
- C20H40O2
- Molecular weight
- 312.53
Names & synonyms
Methyl 10-methyloctadecanoate2490-19-9Tuberculostearic Acid Methyl EsterOctadecanoic acid, 10-methyl-, methyl esterMethyl 10-methyloctadecanoate #methyl 10-methylocta-decanoateSCHEMBL19995790DTXSID00339160ATERKICZYCBQCQ-UHFFFAOYSA-NMFCD00674914HY-16599210-Methyloctadecanoic Acid Methyl Ester; 10-Methylstearic acid Methyl Ester
Show more names
Methyl tuberuculostearate10-Methyloctadecanoic acid methyl ester
Database identifiers
- CAS
2490-19-9- PubChem CID
- 554138
- DTXSID
DTXSID00339160- Nikkaji
- J110.725I
Properties
Computed structural properties
- XLogP
- 8.8
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 17
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 238
Physicochemical properties
- Boiling point
- 151 · 151-158 °C(Press: 2 Torr)
- Density
- 0.8655 g/cm3 · 0.8655 g/cm3
Chemistry & industry
Applications
UsesTuberculostearic Acid Methyl Ester is the methyl ester of Tuberculostearic Acid (T897090) which is a saturated fatty acid produced by Actinomycetales bacteria.
Suppliers5 total
玺标（上海）科技有限公司18512111473 18512111473 · [email protected]
Alfa Chemistry1-516-6625404 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
成都标样生物科技有限公司028-81700200 13308200041 · [email protected]
上海甄准生物科技有限公司18019219489 18901678489 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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