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41991-02-0 |
CAS No: 41991-02-0 Catalog No: AG01FP08 MDL No:
Product Description
Catalog Number:
AG01FP08
CAS Number:
41991-02-0
IUPAC Name:
acetic acid;(2,5-dimethoxy-2H-furan-5-yl)methanol
InChI:
InChI=1S/C7H12O4.C2H4O2/c1-9-6-3-4-7(5-8,10-2)11-6;1-2(3)4/h3-4,6,8H,5H2,1-2H3;1H3,(H,3,4)
InChI Key:
PHXSAVHCJHKSJU-UHFFFAOYSA-N
Properties
Complexity:
188
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
220.095g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
220.221g/mol
Monoisotopic Mass:
220.095g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
85.2A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
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