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15908-06-2 | 3-Furanol, 2-(1,3-butadien-1-yl)tetrahydro-4-(1,3-pentadien-1-yl)-
CAS No: 15908-06-2 Catalog No: AG001QFY MDL No:
Product Description
Catalog Number:
AG001QFY
Chemical Name:
3-Furanol, 2-(1,3-butadien-1-yl)tetrahydro-4-(1,3-pentadien-1-yl)-
CAS Number:
15908-06-2
Molecular Formula:
C13H18O2
Molecular Weight:
206.2808
IUPAC Name:
2-buta-1,3-dienyl-4-penta-1,3-dienyloxolan-3-ol
InChI:
InChI=1S/C13H18O2/c1-3-5-7-8-11-10-15-12(13(11)14)9-6-4-2/h3-9,11-14H,2,10H2,1H3
InChI Key:
DTLKTHCXEMHTIQ-UHFFFAOYSA-N
SMILES:
CC=CC=CC1COC(C1O)C=CC=C
Properties
Complexity:
276
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.131g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
206.285g/mol
Monoisotopic Mass:
206.131g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
3
XLogP3:
2.3
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