Basic information
- CAS
5487-50-3- Standard SMILES
CCC(C)CCCCCCCCCCCC(=O)OC- InChIKey
FRGDXZRZDAJTOU-UHFFFAOYSA-N- Molecular formula
- C17H34O2
- Average molar mass
- 270.5 g/mol
- Monoisotopic mass
- 270.25588032
Names & identifiers
- Preferred name
- Methyl 13-methylpentadecanoate
- IUPAC
- methyl 13-methylpentadecanoate
- English name
- 13-Methylpentadecanoic acid*methyl ester
- Molecular formula
- C17H34O2
- Molecular weight
- 270.45
Names & synonyms
Methyl 13-methylpentadecanoate5487-50-3Pentadecanoic acid, 13-methyl-, methyl esterDTXSID40339164RefChem:353463DTXCID40290246FRGDXZRZDAJTOU-UHFFFAOYSA-N13-methyl Pentadecanoic Acid methyl esterorb2282998methyl 13-methylpen-tadecanoateMethyl 13-methylpentadecanoate #MFCD00053775
Show more names
PD078168HY-114662T8526313-METHYLPENTADECANOIC ACID*METHYL ESTER
Database identifiers
- CAS
5487-50-3- PubChem CID
- 554151
- DTXSID
DTXSID40339164- Nikkaji
- J112.456K
Properties
Computed structural properties
- XLogP
- 7.2
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 14
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 201
Physicochemical properties
- storage temp.
- 2 · 2-8°C
- solubility
- Chloroform: Soluble; Ethanol: Soluble
- LogP
- 7.432 · 7.432 (est)
- WGK Germany
- 3 · 3
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
- wgk
- 3
Chemistry & industry
Applications
UsesMethyl 13-methylpentadecanoate is an ester product.
Suppliers6 total
Alfa Chemistry1-516-6625404 · [email protected]
上海宏叶生物科技有限公司400-9205774 400-920-5774 · [email protected]
ChemeGen 中国18818260767 · [email protected]
上海一飞生物科技有限公司021-65675885 18964387627 · [email protected]
TargetMol中国（陶术生物）15002134094 · [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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