Home Carboxys Ethyl 5-oxooxane-2-carboxylate

Ethyl 5-oxooxane-2-carboxylate

CAS No.:
1408075-77-3
Catalog Number:
AG001CTQ
Molecular Formula:
C8H12O4
Molecular Weight:
172.1785
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
97%
1 week
United States
$400
- +
250mg
97%
1 week
United States
$645
- +
1g
97%
1 week
United States
$1856
- +
Product Description
Catalog Number:
AG001CTQ
Chemical Name:
Ethyl 5-oxooxane-2-carboxylate
CAS Number:
1408075-77-3
Molecular Formula:
C8H12O4
Molecular Weight:
172.1785
MDL Number:
MFCD23106049
IUPAC Name:
ethyl 5-oxooxane-2-carboxylate
InChI:
InChI=1S/C8H12O4/c1-2-11-8(10)7-4-3-6(9)5-12-7/h7H,2-5H2,1H3
InChI Key:
LUBZMSYQUPSNNY-UHFFFAOYSA-N
SMILES:
CCOC(=O)C1CCC(=O)CO1
Properties
Complexity:
188  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
172.074g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
172.18g/mol
Monoisotopic Mass:
172.074g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3  
Properties