Name: Name:lithium(1+) ion 3,3-difluoro-1-(pyridin-4-yl)cyclobutane-1-carboxylate
Brand: Angene
SKU: AG01EKQD
Rating: 90 (10 reviews)

lithium(1+) ion 3,3-difluoro-1-(pyridin-4-yl)cyclobutane-1-carboxylate

CAS No.:

2137536-67-3

Catalog Number:

AG01EKQD

Molecular Formula:

C10H8F2LiNO2

Molecular Weight:

219.1138

Catalog Number:

AG01EKQD

Chemical Name:

lithium(1+) ion 3,3-difluoro-1-(pyridin-4-yl)cyclobutane-1-carboxylate

CAS Number:

2137536-67-3

Molecular Formula:

C10H8F2LiNO2

Molecular Weight:

219.1138

MDL Number:

MFCD31457069

IUPAC Name:

lithium;3,3-difluoro-1-pyridin-4-ylcyclobutane-1-carboxylate

InChI:

InChI=1S/C10H9F2NO2.Li/c11-10(12)5-9(6-10,8(14)15)7-1-3-13-4-2-7;/h1-4H,5-6H2,(H,14,15);/q;+1/p-1

InChI Key:

LSWMSERVPSNEGL-UHFFFAOYSA-M

SMILES:

[O-]C(=O)C1(CC(C1)(F)F)c1ccncc1.[Li+]

Complexity:

272

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

219.068g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

219.116g/mol

Monoisotopic Mass:

219.068g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

53A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count: