Name: Name:TERT-BUTYL 3-BENZYL-4-OXOPYRROLIDINE-1-CARBOXYLATE
Brand: Angene
SKU: AG01EJWU
Rating: 90 (10 reviews)

TERT-BUTYL 3-BENZYL-4-OXOPYRROLIDINE-1-CARBOXYLATE

CAS No.:

897046-05-8

Catalog Number:

AG01EJWU

Molecular Formula:

C16H21NO3

Molecular Weight:

275.3428

Catalog Number:

AG01EJWU

Chemical Name:

TERT-BUTYL 3-BENZYL-4-OXOPYRROLIDINE-1-CARBOXYLATE

CAS Number:

897046-05-8

Molecular Formula:

C16H21NO3

Molecular Weight:

275.3428

MDL Number:

MFCD24470271

IUPAC Name:

tert-butyl 3-benzyl-4-oxopyrrolidine-1-carboxylate

InChI:

InChI=1S/C16H21NO3/c1-16(2,3)20-15(19)17-10-13(14(18)11-17)9-12-7-5-4-6-8-12/h4-8,13H,9-11H2,1-3H3

InChI Key:

MPQKCJLNGYCGON-UHFFFAOYSA-N

SMILES:

O=C(N1CC(C(=O)C1)Cc1ccccc1)OC(C)(C)C

Complexity:

366

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

275.152g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

275.348g/mol

Monoisotopic Mass:

275.152g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

46.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.7