Home Carboxys methyl 4-(hydroxymethyl)-5-methylfuran-2-carboxylate

methyl 4-(hydroxymethyl)-5-methylfuran-2-carboxylate

CAS No.:
209853-87-2
Catalog Number:
AG01B2OE
Molecular Formula:
C8H10O4
Molecular Weight:
170.1626
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01B2OE
Chemical Name:
methyl 4-(hydroxymethyl)-5-methylfuran-2-carboxylate
CAS Number:
209853-87-2
Molecular Formula:
C8H10O4
Molecular Weight:
170.1626
MDL Number:
MFCD28362918
IUPAC Name:
methyl 4-(hydroxymethyl)-5-methylfuran-2-carboxylate
InChI:
InChI=1S/C8H10O4/c1-5-6(4-9)3-7(12-5)8(10)11-2/h3,9H,4H2,1-2H3
InChI Key:
WMMLKFQIKWKPCQ-UHFFFAOYSA-N
SMILES:
COC(=O)c1cc(c(o1)C)CO
Properties
Complexity:
168  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
170.058g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
170.164g/mol
Monoisotopic Mass:
170.058g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
59.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7  
Properties