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294857-29-7 | 2,4-furandimethanol
CAS No: 294857-29-7 Catalog No: AG002YIW MDL No:MFCD16618627
Product Description
Catalog Number:
AG002YIW
Chemical Name:
2,4-furandimethanol
CAS Number:
294857-29-7
Molecular Formula:
C6H8O3
Molecular Weight:
128.1259
MDL Number:
MFCD16618627
IUPAC Name:
[4-(hydroxymethyl)furan-2-yl]methanol
InChI:
InChI=1S/C6H8O3/c7-2-5-1-6(3-8)9-4-5/h1,4,7-8H,2-3H2
InChI Key:
HKGMKJJFLRJMEN-UHFFFAOYSA-N
SMILES:
OCc1occ(c1)CO
Properties
Complexity:
84.4
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
128.047g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
128.127g/mol
Monoisotopic Mass:
128.047g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
53.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.7
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