Name: Name:3-benzyl 1-tert-butyl pyrrolidine-1,3-dicarboxylate
Brand: Angene
SKU: AG01A55M
Rating: 90 (10 reviews)

3-benzyl 1-tert-butyl pyrrolidine-1,3-dicarboxylate

CAS No.:

862885-08-3

Catalog Number:

AG01A55M

Molecular Formula:

C17H23NO4

Molecular Weight:

305.3688

Catalog Number:

AG01A55M

Chemical Name:

3-benzyl 1-tert-butyl pyrrolidine-1,3-dicarboxylate

CAS Number:

862885-08-3

Molecular Formula:

C17H23NO4

Molecular Weight:

305.3688

MDL Number:

MFCD16620827

IUPAC Name:

3-O-benzyl 1-O-tert-butyl pyrrolidine-1,3-dicarboxylate

InChI:

InChI=1S/C17H23NO4/c1-17(2,3)22-16(20)18-10-9-14(11-18)15(19)21-12-13-7-5-4-6-8-13/h4-8,14H,9-12H2,1-3H3

InChI Key:

BESMPWHULNZSGH-UHFFFAOYSA-N

SMILES:

O=C(C1CCN(C1)C(=O)OC(C)(C)C)OCc1ccccc1

Complexity:

396

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

305.163g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

305.374g/mol

Monoisotopic Mass:

305.163g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

55.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.6