Home Carboxys methyl 1,5-dioxaspiro[2.4]heptane-2-carboxylate

methyl 1,5-dioxaspiro[2.4]heptane-2-carboxylate

CAS No.:
1472039-40-9
Catalog Number:
AG01B1Q1
Molecular Formula:
C7H10O4
Molecular Weight:
158.1519
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Product Description
Catalog Number:
AG01B1Q1
Chemical Name:
methyl 1,5-dioxaspiro[2.4]heptane-2-carboxylate
CAS Number:
1472039-40-9
Molecular Formula:
C7H10O4
Molecular Weight:
158.1519
MDL Number:
MFCD21321551
IUPAC Name:
methyl 1,6-dioxaspiro[2.4]heptane-2-carboxylate
InChI:
InChI=1S/C7H10O4/c1-9-6(8)5-7(11-5)2-3-10-4-7/h5H,2-4H2,1H3
InChI Key:
GLSPAUJGXZHULX-UHFFFAOYSA-N
SMILES:
COC(=O)C1OC21COCC2
Properties
Complexity:
191  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
158.058g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
158.153g/mol
Monoisotopic Mass:
158.058g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
48.1A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3  
Properties