Name: Name:3-(2,4-difluorophenyl)-1-azabicyclo[2.2.2]oct-2-ene
Brand: Angene
SKU: AG01B7AQ
Rating: 90 (10 reviews)

3-(2,4-difluorophenyl)-1-azabicyclo[2.2.2]oct-2-ene

CAS No.:

2031260-59-8

Catalog Number:

AG01B7AQ

Molecular Formula:

C13H13F2N

Molecular Weight:

221.2458

Catalog Number:

AG01B7AQ

Chemical Name:

3-(2,4-difluorophenyl)-1-azabicyclo[2.2.2]oct-2-ene

CAS Number:

2031260-59-8

Molecular Formula:

C13H13F2N

Molecular Weight:

221.2458

MDL Number:

MFCD30345231

IUPAC Name:

3-(2,4-difluorophenyl)-1-azabicyclo[2.2.2]oct-2-ene

InChI:

InChI=1S/C13H13F2N/c14-10-1-2-11(13(15)7-10)12-8-16-5-3-9(12)4-6-16/h1-2,7-9H,3-6H2

InChI Key:

GFSSSOPOQZCBMQ-UHFFFAOYSA-N

SMILES:

Fc1ccc(c(c1)F)C1=CN2CCC1CC2

Complexity:

294

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

221.102g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

221.251g/mol

Monoisotopic Mass:

221.102g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

3.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.6