Basic information
- CAS
6969-36-4- Standard SMILES
CC(Cc1ccco1)C(=O)O- InChIKey
BAMODTDOWULALQ-UHFFFAOYSA-N- Molecular formula
- C8H10O3
- Average molar mass
- 154.16 g/mol
- Monoisotopic mass
- 154.06299418
Names & identifiers
- Preferred name
- 3-(Furan-2-yl)-2-methylpropanoic acid
- IUPAC
- 3-(furan-2-yl)-2-methylpropanoic acid
Names & synonyms
3-(furan-2-yl)-2-methylpropanoic acid6969-36-4DTXSID30290376RefChem:275526DTXCID502415222-Furanpropanoicacid, a-methyl-NSC68346MFCD09894697[2-furfur-yl]propionic acidSCHEMBL762539GAA96936NSC-68346
Show more names
3-(2-Furyl)-2-methylpropanoic Acid3-(2-furyl)-2-methyl-propanoic acidAKOS0052182263-(furan-2-yl)-2-methylpropanoicacidSY212600CS-0245240EN300-302144W18641
Database identifiers
- CAS
6969-36-4- PubChem CID
- 249727
- DTXSID
DTXSID30290376
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 50.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 144
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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