Home Other Building Blocks 2,5-bis(hydroxymethyl)furan diacetate

2,5-bis(hydroxymethyl)furan diacetate

CAS No.:
5076-10-8
Catalog Number:
AG01DDZS
Molecular Formula:
C10H12O5
Molecular Weight:
212.1993
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Product Description
Catalog Number:
AG01DDZS
Chemical Name:
2,5-bis(hydroxymethyl)furan diacetate
CAS Number:
5076-10-8
Molecular Formula:
C10H12O5
Molecular Weight:
212.1993
MDL Number:
MFCD00185434
IUPAC Name:
acetic acid;[5-(hydroxymethyl)furan-2-yl]methanol
InChI:
InChI=1S/C6H8O3.2C2H4O2/c7-3-5-1-2-6(4-8)9-5;2*1-2(3)4/h1-2,7-8H,3-4H2;2*1H3,(H,3,4)
InChI Key:
UNKCAFGOOMNPDT-UHFFFAOYSA-N
SMILES:
CC(=O)OCc1ccc(o1)COC(=O)C
Properties
Complexity:
105  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
248.09g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
248.231g/mol
Monoisotopic Mass:
248.09g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
128A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties