Name: Name:2-{[(9H-fluoren-9-yl)methoxy]carbonyl}-2-azabicyclo[2.1.1]hexane-1-carboxylic acid
Brand: Angene
SKU: AG01BKAT
Rating: 90 (10 reviews)

2-{[(9H-fluoren-9-yl)methoxy]carbonyl}-2-azabicyclo[2.1.1]hexane-1-carboxylic acid

CAS No.:

1936396-62-1

Catalog Number:

AG01BKAT

Molecular Formula:

C21H19NO4

Molecular Weight:

349.3799

Catalog Number:

AG01BKAT

Chemical Name:

2-{[(9H-fluoren-9-yl)methoxy]carbonyl}-2-azabicyclo[2.1.1]hexane-1-carboxylic acid

CAS Number:

1936396-62-1

Molecular Formula:

C21H19NO4

Molecular Weight:

349.3799

MDL Number:

MFCD28389226

IUPAC Name:

2-(9H-fluoren-9-ylmethoxycarbonyl)-2-azabicyclo[2.1.1]hexane-1-carboxylic acid

InChI:

InChI=1S/C21H19NO4/c23-19(24)21-9-13(10-21)11-22(21)20(25)26-12-18-16-7-3-1-5-14(16)15-6-2-4-8-17(15)18/h1-8,13,18H,9-12H2,(H,23,24)

InChI Key:

JMVXIHLJJFHMKW-UHFFFAOYSA-N

SMILES:

O=C(N1CC2CC1(C2)C(=O)O)OCC1c2ccccc2c2c1cccc2

Complexity:

577

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

349.131g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

349.386g/mol

Monoisotopic Mass:

349.131g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

66.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.2