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Basic information
- CAS
20962-70-3- Standard SMILES
C=C(C)CC(C(C)=O)C(=O)OCC- InChIKey
DVIFNSDZOSQUGX-UHFFFAOYSA-N- Molecular formula
- C10H16O3
- Average molar mass
- 184.235 g/mol
- Monoisotopic mass
- 184.10994437
Names & identifiers
- Preferred name
- Ethyl 2-acetyl-4-methylpent-4-enoate
- IUPAC
- Ethyl 2-acetyl-4-methylpent-4-enoate
- English name
- 4-Pentenoicacid,2-acetyl-4-methyl-,ethyl
- Molecular formula
- C10H16O3
- Molecular weight
- 184.23
Names & synonyms
Nsc29893ethyl 2-acetyl-4-methylpent-4-enoate4-Pentenoicacid,2-acetyl-4-methyl-,ethyl4-Pentensure, 2-Acetyl-4-methyl-, Ethylester2-acetyl-4-methyl-4-pentenoic acid ethyl ester4-Pentenoic acid, 2-acetyl-4-methyl-, ethyl ester
Database identifiers
- CAS
20962-70-3- PubChem CID
- 97705
- DTXSID
DTXSID1051482- EC Number
- 638-730-2
- Nikkaji
- J674.651I
Properties
Physicochemical properties
- Boiling point
- 114 · 114-116 °C(Press: 20 Torr)
- Density
- 0.972 · 0.972±0.06 g/cm3(Predicted)
- pka
- 11.39 · 11.39±0.59(Predicted)
- LogP
- 1.664 · 1.664 (est)
- EPA Substance Registry System
- 4 · 4-Pentenoic acid, 2-acetyl-4-methyl-, ethyl ester (20962-70-3)
- TSCA
- TSCA listed
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
- tsca
- TSCA listed
Chemistry & industry
Upstream & downstream products
Downstream products
Suppliers3 total
凯美赛尔生物医药有限公司020-13556033878 2965585218 13556033878 · [email protected]
陕西缔都医药化工有限公司029-029-81120477 17792793610 · [email protected]
河南伊诺凯新材料有限公司15090072163 · [email protected]
Related reactions
4 records
Compound notes
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