C1CN(CCN1)CCCC2=CC=C(C=C2)Cl
CAS: 59214-26-5
Nom: 1-[3-(4-chlorophenyl)propyl]piperazine
SMILES: C1CN(CCN1)CCCC2=CC=C(C=C2)Cl

Molecular Processing

Molecular formula
C13H19ClN2
Molecular weight
238.76
Exact mass
238.1237
XLogP
2.18
TPSA
15.27
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
4
Heavy atoms
16
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.538
Molar refractivity
69.08

Supplementary Information

InChIKey: VOBMEQLWIVXPEP-UHFFFAOYSA-N
Synonymes
1-[3-(4-chlorophenyl)propyl]piperazine59214-26-51-(3-(4-Chlorophenyl)propyl)piperazine1-CpppiDTXSID80207959RefChem:74265DTXCID80130450MFCD09894982SCHEMBL9319743VOBMEQLWIVXPEP-UHFFFAOYSA-N3-(4-chlorophenyl)propyl piperazineAKOS0159458771[3-(4-chlorophenyl)propyl]-piperazineNS-03296DB-353888CS-0363421Piperazine, 1-(3-(4-chlorophenyl)propyl)-
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Recherche Etendue

Recherche de Sous-structure→Recherche de Similitude→