Basic information
- CAS
124-00-5- Standard SMILES
O=C(O)C=CCCCCCCCCC(=O)O- InChIKey
MAZWDMBCPDUFDJ-UHFFFAOYSA-N- Molecular formula
- C12H20O4
- Average molar mass
- 228.28 g/mol
- Monoisotopic mass
- 228.13615911
Overview
2-dodecenedioic acid has been reported in Meehania urticifolia with data available.
Names & identifiers
- Preferred name
- 2-Dodecenedioic acid
- IUPAC
- dodec-2-enedioic acid
- English name
- 2-Dodecenedioic acid
- Molecular formula
- C12H20O4
- Molecular weight
- 228.29
Names & synonyms
124-00-52-dodecendisaure2-Dodecenedioic acid1-Decene-1,10-dicarboxylic acidNSC 8125SCHEMBL38780155454-16-3NS00047422S61632-dodecendioic acid
Database identifiers
- CAS
124-00-5- PubChem CID
- 22904
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 74.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 10
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 233
Physicochemical properties
- Melting point
- 165 °C · 165 °C
- Boiling point
- 376.425 · 376.425±15.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 1.09 · 1.090±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- pka
- 4.484 · 4.484±0.10(predicted)
- LogP
- 2.95 · 2.950 (est)
Chemistry & industry
Suppliers4 total
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
成都格里迈特医药技术有限公司17308078590; 15928855497 · [email protected]
成都卡麦尔医药科技有限公司028-67136579 15828051124 · [email protected]
杭州洁汉化工有限公司+86-571-86217390; +8618058761490 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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