CCCCCCCCCCC=O
CAS: 112-44-7
Name: undecanal
SMILES: CCCCCCCCCCC=O

Molecular Processing

Molecular formula
C11H22O
Molecular weight
170.3
Exact mass
170.1671
XLogP
3.72
TPSA
17.07
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
9
Heavy atoms
12
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
1
Covalent units
1
Fraction Csp3
0.909
Molar refractivity
53.29

Supplementary Information

InChIKey: KMPQYAYAQWNLME-UHFFFAOYSA-N
Synonyme
UNDECANAL112-44-7Undecyl aldehydeUndecanaldehyden-UndecanalUndecylic aldehyde1-UndecanalHendecanalUndecylaldehydeHendecanaldehyden-Undecyl aldehydeC11 aldehydeUndecanone, alpha-FEMA No. 3092DTXSID4021688B6P0A9PSHNNSC-22578DTXCID901688CHEBI:46202RefChem:193068203-972-6Aldehyde C-11C-11 aldehyde, undecylicAldehyde C-11, undecylicMFCD00007016NSC 22578Undecanal (natural)EINECS 203-972-6UNII-B6P0A9PSHNBRN 1753213
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