CCCCC1=NC=C(N1CC2=CC=CC=C2Cl)C=O
CAS: 133485-56-0
名称: 2-butyl-3-[(2-chlorophenyl)methyl]imidazole-4-carbaldehyde
SMILES: CCCCC1=NC=C(N1CC2=CC=CC=C2Cl)C=O

Molecular Processing

Molecular formula
C15H17ClN2O
Molecular weight
276.77
Exact mass
276.1029
XLogP
3.74
TPSA
34.89
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
6
Heavy atoms
19
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
76.78

Supplementary Information

InChIKey: VYLHMXUTTRBZEK-UHFFFAOYSA-N
同義語
133485-56-01H-Imidazole-5-carboxaldehyde, 2-butyl-1-[(2-chlorophenyl)methyl]-SCHEMBL6960759DTXSID30435765VYLHMXUTTRBZEK-UHFFFAOYSA-N2-Butyl-1-[(2-chlorophenyl)methyl]-1H-imidazole-5-carbaldehyde2-n-butyl-1-(2-chlorophenyl)methyl-1H-imidazol-5-carboxaldehyde2-n-butyl-1-(2-chlorophenyl)methyl-1H-imidazole-5-carboxaldehyde2-n-butyl-1-[(2-chlorophenyl)methyl]-1H-imidazol-5-carboxaldehyde
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