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Home > Aldehydes > 824940-62-7
824940-62-7 | 1,4-Dioxaspiro[4.4]nonane-7-carboxaldehyde, 7-methyl-, (7S)-
CAS No: 824940-62-7 Catalog No: AG005950 MDL No:
Product Description
Catalog Number:
AG005950
Chemical Name:
1,4-Dioxaspiro[4.4]nonane-7-carboxaldehyde, 7-methyl-, (7S)-
CAS Number:
824940-62-7
Molecular Formula:
C9H14O3
Molecular Weight:
170.2057
IUPAC Name:
(8S)-8-methyl-1,4-dioxaspiro[4.4]nonane-8-carbaldehyde
InChI:
InChI=1S/C9H14O3/c1-8(7-10)2-3-9(6-8)11-4-5-12-9/h7H,2-6H2,1H3/t8-/m0/s1
InChI Key:
LIPFNECAAVDNKC-QMMMGPOBSA-N
SMILES:
O=C[C@@]1(C)CCC2(C1)OCCO2
Properties
Complexity:
196
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
170.094g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
170.208g/mol
Monoisotopic Mass:
170.094g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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