alpha-Methyl-2-furanpropanol
Basic information
- CAS
6963-39-9- Standard SMILES
CC(O)CCc1ccco1- InChIKey
WJKRHTCMSSXHNV-UHFFFAOYSA-N- Molecular formula
- C8H12O2
- Average molar mass
- 140.18 g/mol
- Monoisotopic mass
- 140.08372962
Names & identifiers
- Preferred name
- alpha-Methyl-2-furanpropanol
- IUPAC
- 4-(furan-2-yl)butan-2-ol
- English name
- α-Methyl-2-furan-1-propanol
- Molecular formula
- C8H12O2
- Molecular weight
- 140.17968
Names & synonyms
6963-39-9alpha-Methyl-2-furanpropanol2-FURANPROPANOL, alpha-METHYL-DTXSID501318847RefChem:1076525DTXCID8017425784-(furan-2-yl)butan-2-olNSC 53774BRN 0081113WLN: T5OJ B2YQ12-Furanpropanol, .alpha.-methyl-NSC53774
Show more names
α-Methyl-2-furan-1-propanol
1-(a-furyl)-3-butanol4-(2-furyl)-2-butanol5-17-03-00403 (Beilstein Handbook Reference)I+/--Methyl-2-furanpropanolSCHEMBL217177282-FURANPROPANOL, A-METHYL-NSC-53774AKOS009540696
Database identifiers
- CAS
6963-39-9- PubChem CID
- 23400
- DTXSID
DTXSID501318847- Nikkaji
- J49.600F
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 33.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 93.3
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…