الاسم: N-BOC-1,3-dihydro-2H-isoindol-1-carboxylic acid, methyl ester
SMILES:
COC(=O)C1c2ccccc2CN1C(=O)OC(C)(C)CMolecular Processing
Molecular formula
C15H19NO4
Molecular weight
277.32
Exact mass
277.1314
XLogP
2.65
TPSA
55.84
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
1
Heavy atoms
20
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.467
Molar refractivity
72.98
Supplementary Information
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