Home Carboxys ethyl 4-?hydroxyoxane-?2-?carboxylate

ethyl 4-?hydroxyoxane-?2-?carboxylate

CAS No.:
1822505-24-7
Catalog Number:
AG0023J9
Molecular Formula:
C8H14O4
Molecular Weight:
174.1944
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Product Description
Catalog Number:
AG0023J9
Chemical Name:
ethyl 4-?hydroxyoxane-?2-?carboxylate
CAS Number:
1822505-24-7
Molecular Formula:
C8H14O4
Molecular Weight:
174.1944
IUPAC Name:
ethyl 4-hydroxyoxane-2-carboxylate
InChI:
InChI=1S/C8H14O4/c1-2-11-8(10)7-5-6(9)3-4-12-7/h6-7,9H,2-5H2,1H3
InChI Key:
QTTRVQVEPJZWQD-UHFFFAOYSA-N
SMILES:
CCOC(=O)C1CC(O)CCO1
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