C1CCCCCC(CCCCC1)C=O
CAS: 5037-22-9
Name: cyclododecanecarbaldehyde
SMILES: C1CCCCCC(CCCCC1)C=O

Molecular Processing

Molecular formula
C13H24O
Molecular weight
196.33
Exact mass
196.1827
XLogP
4.11
TPSA
17.07
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
1
Heavy atoms
14
Rings
1
Aromatic rings
0
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
1
Covalent units
1
Fraction Csp3
0.923
Molar refractivity
60.34

Supplementary Information

InChIKey: KIYUNVUWDQKWPJ-UHFFFAOYSA-N
Synonyme
Cyclododecaneformylcarboxylic acidCyclododecanecarboxaldehydeS64SQQ4UJREINECS 225-731-4NSC-524962DTXSID50198421NSC 524962RefChem:129452DTXCID80120912cyclododecanecarbaldehyde5037-22-9NSC524962cyclododecancarbaldehydUNII-S64SQQ4UJRcyclododecane carboxaldehydeSCHEMBL329468SCHEMBL329469FAA03722AKOS015258588DS-002608CS-0258303NS00045316EN300-697248Z1268606432
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