Home Carboxys 1,4-dioxaspiro[5.5]undecane-9-carboxylic acid

1,4-dioxaspiro[5.5]undecane-9-carboxylic acid

CAS No.:
1547039-39-3
Catalog Number:
AG01DVM4
Molecular Formula:
C10H16O4
Molecular Weight:
200.2316
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Product Description
Catalog Number:
AG01DVM4
Chemical Name:
1,4-dioxaspiro[5.5]undecane-9-carboxylic acid
CAS Number:
1547039-39-3
Molecular Formula:
C10H16O4
Molecular Weight:
200.2316
MDL Number:
MFCD31665305
IUPAC Name:
1,4-dioxaspiro[5.5]undecane-9-carboxylic acid
InChI:
InChI=1S/C10H16O4/c11-9(12)8-1-3-10(4-2-8)7-13-5-6-14-10/h8H,1-7H2,(H,11,12)
InChI Key:
OZDLTPZBZMCAOV-UHFFFAOYSA-N
SMILES:
OC(=O)C1CCC2(CC1)OCCOC2
Properties
Complexity:
218  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
200.105g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
200.234g/mol
Monoisotopic Mass:
200.105g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
55.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3  
Properties