Home Carboxys Methyl 4-acetyl-5-methylfuran-2-carboxylate

Methyl 4-acetyl-5-methylfuran-2-carboxylate

CAS No.:
29172-10-9
Catalog Number:
AG002XL1
Molecular Formula:
C9H10O4
Molecular Weight:
182.1733
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$96
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Product Description
Catalog Number:
AG002XL1
Chemical Name:
Methyl 4-acetyl-5-methylfuran-2-carboxylate
CAS Number:
29172-10-9
Molecular Formula:
C9H10O4
Molecular Weight:
182.1733
MDL Number:
MFCD00463178
IUPAC Name:
methyl 4-acetyl-5-methylfuran-2-carboxylate
InChI:
InChI=1S/C9H10O4/c1-5(10)7-4-8(9(11)12-3)13-6(7)2/h4H,1-3H3
InChI Key:
NWZJIFQWVPVKLV-UHFFFAOYSA-N
SMILES:
COC(=O)c1oc(c(c1)C(=O)C)C
Properties
Complexity:
224  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
182.058g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
182.175g/mol
Monoisotopic Mass:
182.058g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
56.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties