Name: Name:(2S,3aS,6aS)-2-benzyl 1-tert-butyl hexahydrocyclopenta[b]pyrrole-1,2(2H)-dicarboxylate
Brand: Angene
SKU: AG01DFM1
Rating: 90 (10 reviews)

(2S,3aS,6aS)-2-benzyl 1-tert-butyl hexahydrocyclopenta[b]pyrrole-1,2(2H)-dicarboxylate

CAS No.:

124002-38-6

Catalog Number:

AG01DFM1

Molecular Formula:

C20H27NO4

Molecular Weight:

345.4327

Catalog Number:

AG01DFM1

Chemical Name:

(2S,3aS,6aS)-2-benzyl 1-tert-butyl hexahydrocyclopenta[b]pyrrole-1,2(2H)-dicarboxylate

CAS Number:

124002-38-6

Molecular Formula:

C20H27NO4

Molecular Weight:

345.4327

MDL Number:

MFCD28246606

IUPAC Name:

2-O-benzyl 1-O-tert-butyl (2S,3aS,6aS)-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]pyrrole-1,2-dicarboxylate

InChI:

InChI=1S/C20H27NO4/c1-20(2,3)25-19(23)21-16-11-7-10-15(16)12-17(21)18(22)24-13-14-8-5-4-6-9-14/h4-6,8-9,15-17H,7,10-13H2,1-3H3/t15-,16-,17-/m0/s1

InChI Key:

NXEGYGPYSYLFSB-ULQDDVLXSA-N

SMILES:

O=C([C@@H]1C[C@H]2[C@@H](N1C(=O)OC(C)(C)C)CCC2)OCc1ccccc1

Complexity:

492

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

345.194g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

345.439g/mol

Monoisotopic Mass:

345.194g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

55.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.9