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249563-53-9 | Spiro[2.2]pentane-1-carboxylic acid, (1R)-
CAS No: 249563-53-9 Catalog No: AG002PZ4 MDL No:
Product Description
Catalog Number:
AG002PZ4
Chemical Name:
Spiro[2.2]pentane-1-carboxylic acid, (1R)-
CAS Number:
249563-53-9
Molecular Formula:
C6H8O2
Molecular Weight:
112.1265
IUPAC Name:
(2R)-spiro[2.2]pentane-2-carboxylic acid
InChI:
InChI=1S/C6H8O2/c7-5(8)4-3-6(4)1-2-6/h4H,1-3H2,(H,7,8)/t4-/m0/s1
InChI Key:
WAHIIXTYAWFIFE-BYPYZUCNSA-N
SMILES:
OC(=O)[C@@H]1CC21CC2
Properties
Complexity:
147
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
112.052g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
112.128g/mol
Monoisotopic Mass:
112.052g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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