Name: Name:Racemic-(1S,3S,4S,5R)-2-Benzyl 3-Ethyl 5-Hydroxy-2-Azabicyclo[2.2.1]Heptane-2,3-Dicarboxylate
Brand: Angene
SKU: AG00HDXV
Rating: 90 (10 reviews)

Racemic-(1S,3S,4S,5R)-2-Benzyl 3-Ethyl 5-Hydroxy-2-Azabicyclo[2.2.1]Heptane-2,3-Dicarboxylate

CAS No.:

1173294-41-1

Catalog Number:

AG00HDXV

Molecular Formula:

C17H21NO5

Molecular Weight:

319.3523

Catalog Number:

AG00HDXV

Chemical Name:

Racemic-(1S,3S,4S,5R)-2-Benzyl 3-Ethyl 5-Hydroxy-2-Azabicyclo[2.2.1]Heptane-2,3-Dicarboxylate

CAS Number:

1173294-41-1

Molecular Formula:

C17H21NO5

Molecular Weight:

319.3523

MDL Number:

MFCD28390406

IUPAC Name:

2-O-benzyl 3-O-ethyl 5-hydroxy-2-azabicyclo[2.2.1]heptane-2,3-dicarboxylate

InChI:

InChI=1S/C17H21NO5/c1-2-22-16(20)15-13-8-12(9-14(13)19)18(15)17(21)23-10-11-6-4-3-5-7-11/h3-7,12-15,19H,2,8-10H2,1H3

InChI Key:

HNERQWYMBMKIIU-UHFFFAOYSA-N

SMILES:

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

Complexity:

448

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

319.142g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

319.357g/mol

Monoisotopic Mass:

319.142g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

76.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.9