Home Carboxys 2H-Pyran-2-carboxylic acid, tetrahydro-5-hydroxy-, ethyl ester

2H-Pyran-2-carboxylic acid, tetrahydro-5-hydroxy-, ethyl ester

CAS No.:
110407-58-4
Catalog Number:
AG00HBPO
Molecular Formula:
C8H14O4
Molecular Weight:
174.1944
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG00HBPO
Chemical Name:
2H-Pyran-2-carboxylic acid, tetrahydro-5-hydroxy-, ethyl ester
CAS Number:
110407-58-4
Molecular Formula:
C8H14O4
Molecular Weight:
174.1944
MDL Number:
MFCD23106047
IUPAC Name:
ethyl 5-hydroxyoxane-2-carboxylate
InChI:
InChI=1S/C8H14O4/c1-2-11-8(10)7-4-3-6(9)5-12-7/h6-7,9H,2-5H2,1H3
InChI Key:
ZEJKVCZXCLPEPS-UHFFFAOYSA-N
SMILES:
CCOC(=O)C1CCC(CO1)O
Properties
Complexity:
157  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
174.089g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
174.196g/mol
Monoisotopic Mass:
174.089g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
55.8A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3  
Properties