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Home > Aldehydes > 116430-36-5
116430-36-5 | 4,8-Cyclododecadiene-1-carboxaldehyde, (4E,8Z)-
CAS No: 116430-36-5 Catalog No: AG000CH4 MDL No:
Product Description
Catalog Number:
AG000CH4
Chemical Name:
4,8-Cyclododecadiene-1-carboxaldehyde, (4E,8Z)-
CAS Number:
116430-36-5
Molecular Formula:
C13H20O
Molecular Weight:
192.2973
IUPAC Name:
cyclododeca-4,8-diene-1-carbaldehyde
InChI:
InChI=1S/C13H20O/c14-12-13-10-8-6-4-2-1-3-5-7-9-11-13/h2,4-5,7,12-13H,1,3,6,8-11H2
InChI Key:
OAPGEXRXFPLLLJ-UHFFFAOYSA-N
SMILES:
O=CC1CCC/C=C\CC/C=C/CC1
Properties
Complexity:
203
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.151g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
192.302g/mol
Monoisotopic Mass:
192.151g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
2
XLogP3:
3.5
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