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19958-66-8 | 2-Furanbutanol
CAS No: 19958-66-8 Catalog No: AG002C79 MDL No:
Product Description
Catalog Number:
AG002C79
Chemical Name:
2-Furanbutanol
CAS Number:
19958-66-8
Molecular Formula:
C8H12O2
Molecular Weight:
140.1797
IUPAC Name:
4-(furan-2-yl)butan-1-ol
InChI:
InChI=1S/C8H12O2/c9-6-2-1-4-8-5-3-7-10-8/h3,5,7,9H,1-2,4,6H2
InChI Key:
KUGYYICTOVROHW-UHFFFAOYSA-N
SMILES:
OCCCCc1ccco1
Properties
Complexity:
83.3
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
140.084g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
140.182g/mol
Monoisotopic Mass:
140.084g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
33.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
Literature
| Title | Journal |
|---|---|
| Oxidative spirocyclisation routes towards the sawaranospirolides. Synthesis of ent-sawaranospirolides C and D. | Organic & biomolecular chemistry 20100107 |
| Stereoselective synthesis of the lituarine tricyclic spiroacetal. | Organic letters 20041014 |
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