Basic information
- CAS
15971-31-0- Standard SMILES
CCOC(=O)C=Cc1ccc(OC)c2ccccc12- InChIKey
VBZWLZWCHZBRPA-UHFFFAOYSA-N- Molecular formula
- C16H16O3
- Average molar mass
- 256.3 g/mol
- Monoisotopic mass
- 256.10994437
Names & identifiers
- Preferred name
- Ethyl 3-(4-methoxynaphthalen-1-yl)prop-2-enoate
- IUPAC
- ethyl 3-(4-methoxynaphthalen-1-yl)prop-2-enoate
- English name
- ethyl 3-(4-methoxy-1-naphthyl)-2-propenoate
- Molecular formula
- C16H16O3
- Molecular weight
- 256.3
Names & synonyms
Ethyl 3-(4-methoxynaphthalen-1-yl)prop-2-enoate15971-31-02-Propenoic acid, 3-(4-methoxy-1-naphthalenyl)-, ethyl esterMFCD26142155SCHEMBL2689193DTXSID80737387DB-187331ethyl 3-(4-methoxy-1-naphthyl)prop-2-enoateD92905F843900ethyl 3-(4-methoxy-1-naphthyl)-2-propenoate
Database identifiers
- CAS
15971-31-0- PubChem CID
- 67499080
- DTXSID
DTXSID80737387
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 324
Physicochemical properties
- Melting point
- 59 °C · 59 °C(Solv: ethanol (64-17-5))
- Boiling point
- 230 · 230-240 °C(Press: 10 Torr)
- Density
- 1.138 · 1.138±0.06 g/cm3(Predicted)
Chemistry & industry
Suppliers5 total
南京凯姆铂医药科技有限公司025-66162170
江苏艾康生物医药研发有限公司025-66113011 19370895928 · [email protected]
上海凯为化学科技有限公司021-58461859 15821823057 · [email protected]
合肥钼凯医药科技有限公司18001872185; 18001872185 · [email protected]
Nanjing Moldeep Biochemical Co., Ltd.+86-25-58282389 +86-17351037455 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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