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Home > Aldehydes > 125439-81-8
125439-81-8 | 1,2-Cyclohexanedicarboxaldehyde, (1R,2S)-rel-
CAS No: 125439-81-8 Catalog No: AG000NP8 MDL No:
Product Description
Catalog Number:
AG000NP8
Chemical Name:
1,2-Cyclohexanedicarboxaldehyde, (1R,2S)-rel-
CAS Number:
125439-81-8
Molecular Formula:
C8H12O2
Molecular Weight:
140.1797
IUPAC Name:
(1S,2R)-cyclohexane-1,2-dicarbaldehyde
InChI:
InChI=1S/C8H12O2/c9-5-7-3-1-2-4-8(7)6-10/h5-8H,1-4H2/t7-,8+
InChI Key:
AOVGTXWIQWMZGB-OCAPTIKFSA-N
SMILES:
O=C[C@@H]1CCCC[C@@H]1C=O
Properties
Complexity:
115
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
140.084g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
140.182g/mol
Monoisotopic Mass:
140.084g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
34.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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