CC(C)(C)OC(=O)N1CC(CC1OC)C2=CC(=CC(=C2)Cl)Cl
CAS: 1203587-02-3
الاسم: tert-butyl 4-(3,5-dichlorophenyl)-2-methoxypyrrolidine-1-carboxylate
SMILES: CC(C)(C)OC(=O)N1CC(CC1OC)C2=CC(=CC(=C2)Cl)Cl

Molecular Processing

Molecular formula
C16H21Cl2NO3
Molecular weight
346.25
Exact mass
345.0898
XLogP
4.69
TPSA
38.77
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
22
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.562
Molar refractivity
87.56

Supplementary Information

InChIKey: MHKRMHWWHXXJHH-UHFFFAOYSA-N
مرادفات
tert-butyl 4-(3,5-dichlorophenyl)-2-methoxypyrrolidine-1-carboxylate1203587-02-3SCHEMBL826257MHKRMHWWHXXJHH-UHFFFAOYSA-NDB-309341
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