CAS: 195507-51-8
名称: [1-(2-chloroethyl)piperidin-4-yl]-phenylmethanone
SMILES:
C1CN(CCC1C(=O)C2=CC=CC=C2)CCClMolecular Processing
Molecular formula
C14H18ClNO
Molecular weight
251.76
Exact mass
251.1077
XLogP
2.82
TPSA
20.31
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
4
Heavy atoms
17
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
0.5
Molar refractivity
70.66
Supplementary Information
InChIKey: LZFQPFGGUFULHI-UHFFFAOYSA-N
同義語
195507-51-8(1-(2-Chloroethyl)piperidin-4-yl)(phenyl)methanone[1-(2-Chloroethyl)-4-piperidyl](phenyl)methanoneSCHEMBL20577435LZFQPFGGUFULHI-UHFFFAOYSA-N1-(2-chloroethyl)-4-benzoylpiperidineSY399154
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