Home Carboxys 4-(oxan-4-yl)oxane-4-carboxylic acid

4-(oxan-4-yl)oxane-4-carboxylic acid

CAS No.:
1531559-20-2
Catalog Number:
AG01DVJZ
Molecular Formula:
C11H18O4
Molecular Weight:
214.2582
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Product Description
Catalog Number:
AG01DVJZ
Chemical Name:
4-(oxan-4-yl)oxane-4-carboxylic acid
CAS Number:
1531559-20-2
Molecular Formula:
C11H18O4
Molecular Weight:
214.2582
MDL Number:
MFCD21922532
IUPAC Name:
4-(oxan-4-yl)oxane-4-carboxylic acid
InChI:
InChI=1S/C11H18O4/c12-10(13)11(3-7-15-8-4-11)9-1-5-14-6-2-9/h9H,1-8H2,(H,12,13)
InChI Key:
FKLFQDNGNZHIKY-UHFFFAOYSA-N
SMILES:
OC(=O)C1(CCOCC1)C1CCOCC1
Properties
Complexity:
227  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
214.121g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
214.261g/mol
Monoisotopic Mass:
214.121g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
55.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5  
Properties