C1CC(NC1)C(=O)OCC2=CC=CC=C2
CAS: 80089-25-4
Name: benzyl pyrrolidine-2-carboxylate
SMILES: C1CC(NC1)C(=O)OCC2=CC=CC=C2

Molecular Processing

Molecular formula
C12H15NO2
Molecular weight
205.26
Exact mass
205.1103
XLogP
1.48
TPSA
38.33
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
15
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.417
Molar refractivity
57.26

Supplementary Information

InChIKey: VVCLBQFBKZQOAF-UHFFFAOYSA-N
Synonyme
Proline benzyl esterRefChem:930021benzyl pyrrolidine-2-carboxylate80089-25-4dl-proline benzyl esterbenzyl prolinate hydrochloridepyrrolidine-2-carboxylic acid benzyl esterNSC-206250benzyl DL prolinatebenzyl DL-prolinateEINECS 255-314-2NSC 206250MTH2QY5GZ6d,l-proline, benzyl esterProline benzyl ester, DL-Proline, phenylmethyl esterNCIOpen2_003272SCHEMBL6933512-benzyloxycarbonyl-pyrrolidinebenzylpyrrolidine-2-carboxylateSCHEMBL20782102-(benzyloxycarbonyl)pyrrolidineVVCLBQFBKZQOAF-UHFFFAOYSA-NALBB-023414NSC206250phenylmethyl pyrrolidine-2-carboxylaterac.-2-(benzyloxycarbonyl)pyrrolidineAKOS009129558DB-321436pyrrolidin-2-yl carboxylic acid benzyl ester
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