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828916-66-1 | 2(5H)-Furanone, 4-[3-(tetrahydro-2-furanyl)propoxy]-
CAS No: 828916-66-1 Catalog No: AG0054XX MDL No:
Product Description
Catalog Number:
AG0054XX
Chemical Name:
2(5H)-Furanone, 4-[3-(tetrahydro-2-furanyl)propoxy]-
CAS Number:
828916-66-1
Molecular Formula:
C11H16O4
Molecular Weight:
212.2423
IUPAC Name:
3-[3-(oxolan-2-yl)propoxy]-2H-furan-5-one
InChI:
InChI=1S/C11H16O4/c12-11-7-10(8-15-11)14-6-2-4-9-3-1-5-13-9/h7,9H,1-6,8H2
InChI Key:
QOJHIPDDILJYHV-UHFFFAOYSA-N
SMILES:
O=C1OCC(=C1)OCCCC1CCCO1
Properties
Complexity:
259
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.105g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
212.245g/mol
Monoisotopic Mass:
212.105g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
44.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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