Home Carboxys Spiro[3.3]heptane-2-carboxylic acid, ethyl ester

Spiro[3.3]heptane-2-carboxylic acid, ethyl ester

CAS No.:
1255098-89-5
Catalog Number:
AG000NRO
Molecular Formula:
C10H16O2
Molecular Weight:
168.2328
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Product Description
Catalog Number:
AG000NRO
Chemical Name:
Spiro[3.3]heptane-2-carboxylic acid, ethyl ester
CAS Number:
1255098-89-5
Molecular Formula:
C10H16O2
Molecular Weight:
168.2328
MDL Number:
MFCD17926381
IUPAC Name:
ethyl spiro[3.3]heptane-2-carboxylate
InChI:
InChI=1S/C10H16O2/c1-2-12-9(11)8-6-10(7-8)4-3-5-10/h8H,2-7H2,1H3
InChI Key:
QLUZVFLEMYGSTE-UHFFFAOYSA-N
SMILES:
CCOC(=O)C1CC2(C1)CCC2
Properties
Complexity:
186  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.115g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
168.236g/mol
Monoisotopic Mass:
168.115g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Properties