Home Carboxys Ethyl 3-oxotetrahydro-2H-pyran-2-carboxylate

Ethyl 3-oxotetrahydro-2H-pyran-2-carboxylate

CAS No.:
122061-03-4
Catalog Number:
AG0016PB
Molecular Formula:
C8H12O4
Molecular Weight:
172.1785
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
97%
1 week
United States
$225
- +
250mg
97%
1 week
United States
$414
- +
1g
97%
1 week
United States
$981
- +
5g
97%
1 week
United States
$2867
- +
10g
97%
1 week
United States
$4753
- +
Product Description
Catalog Number:
AG0016PB
Chemical Name:
Ethyl 3-oxotetrahydro-2H-pyran-2-carboxylate
CAS Number:
122061-03-4
Molecular Formula:
C8H12O4
Molecular Weight:
172.1785
MDL Number:
MFCD24696375
IUPAC Name:
ethyl 3-oxooxane-2-carboxylate
InChI:
InChI=1S/C8H12O4/c1-2-11-8(10)7-6(9)4-3-5-12-7/h7H,2-5H2,1H3
InChI Key:
NDFQAZPUWNIQNX-UHFFFAOYSA-N
SMILES:
CCOC(=O)C1OCCCC1=O
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:
0.5  
Properties