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Home > Aldehydes > 129896-07-7
129896-07-7 | 1,4-Dioxaspiro[4.4]nonane-2-carboxaldehyde, 3,3-dimethyl-, (2R)-
CAS No: 129896-07-7 Catalog No: AG000TRP MDL No:
Product Description
Catalog Number:
AG000TRP
Chemical Name:
1,4-Dioxaspiro[4.4]nonane-2-carboxaldehyde, 3,3-dimethyl-, (2R)-
CAS Number:
129896-07-7
Molecular Formula:
C10H16O3
Molecular Weight:
184.2322
IUPAC Name:
3,3-dimethyl-1,4-dioxaspiro[4.4]nonane-2-carbaldehyde
InChI:
InChI=1S/C10H16O3/c1-9(2)8(7-11)12-10(13-9)5-3-4-6-10/h7-8H,3-6H2,1-2H3
InChI Key:
TWSIOPPJMVNENZ-UHFFFAOYSA-N
SMILES:
O=C[C@@H]1OC2(OC1(C)C)CCCC2
Properties
Complexity:
216
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
184.11g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
184.235g/mol
Monoisotopic Mass:
184.11g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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