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Home > Aldehydes > 919530-89-5
919530-89-5 | 2-Furancarboxaldehyde, 4-[(acetyloxy)methyl]-
CAS No: 919530-89-5 Catalog No: AG006IAG MDL No:
Product Description
Catalog Number:
AG006IAG
Chemical Name:
2-Furancarboxaldehyde, 4-[(acetyloxy)methyl]-
CAS Number:
919530-89-5
Molecular Formula:
C8H8O4
Molecular Weight:
168.1467
IUPAC Name:
(5-formylfuran-3-yl)methyl acetate
InChI:
InChI=1S/C8H8O4/c1-6(10)11-4-7-2-8(3-9)12-5-7/h2-3,5H,4H2,1H3
InChI Key:
WUUUDNOHBDZGIV-UHFFFAOYSA-N
SMILES:
O=Cc1occ(c1)COC(=O)C
Properties
Complexity:
178
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.042g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
168.148g/mol
Monoisotopic Mass:
168.042g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
56.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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