Lithium difluoro(oxalato)borate(1-)

C₂BF₂LiO₄CAS 409071-16-5143.76 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₂BF₂LiO₄
Molar mass: 143.76 g/mol
Exact mass: 144.0018 Da
logP: -3.54Crippen estimate
Polar surface area: 52.6 Å²
H-bond donors / acceptors: 0 / 4
Rotatable bonds: 0

Hazards

Danger

H301 Toxic if swallowed54.7% of notifiers
H315 Causes skin irritation98.9% of notifiers
H318 Causes serious eye damage76.8% of notifiers
H319 Causes serious eye irritation23.2% of notifiers
H335 May cause respiratory irritation23.2% of notifiers
H400 Very toxic to aquatic life75.8% of notifiers
H410 Very toxic to aquatic life with long lasting effects75.8% of notifiers

Aggregated from 190 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P273, P280, P301+P316, P302+P352, P304+P340, P305+P351+P338, P305+P354+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P391, P403+P233, P405, P501

Identifiers

CAS number

409071-16-5

SMILES

[Li+].[B-]1(OC(=O)C(=O)O1)(F)F

InChIKey

MEDDCIKGDMDORY-UHFFFAOYSA-N

InChI

InChI=1S/C2BF2O4.Li/c4-3(5)8-1(6)2(7)9-3;/q-1;+1

Weigh it out

Type any one amount. The others follow from the molar mass.

Work with Lithium difluoro(oxalato)borate(1-)

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Lithium bis(oxalato)borate244761-29-357 % similar Acetic acid-boron trifluoride complex (2:1)373-61-531 % similar Dimethyl oxalate553-90-230 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

PubChem CAS Common Chemistry NIST WebBook