CAS 64992-03-6 4-Bromomethyl-2-fluoropyridine (HCID 13985168)

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Basic information

CAS: 64992-03-6
Standard SMILES: Fc1cc(CBr)ccn1
InChIKey: QVTCEZINLKFYJJ-UHFFFAOYSA-N
Molecular formula: C6H5BrFN
Average molar mass: 190.01 g/mol

Names & identifiers

Preferred name: 4-Bromomethyl-2-fluoropyridine
IUPAC: 4-(bromomethyl)-2-fluoropyridine
English name: 4-(bromomethyl)-2-fluoropyridine
Molecular formula: C6H5BrFN
Molecular weight: 190.01

Names & synonyms

64992-03-64-bromomethyl-2-fluoropyridineRefChem:520509972-494-44-(bromomethyl)-2-fluoropyridineMFCD09953531SCHEMBL501592SCHEMBL298939024-Bromomethyl-2-fluoro-pyridine2-fluoro-4-(bromomethyl)pyridineQVTCEZINLKFYJJ-UHFFFAOYSA-N4-(bromomethyl)-2-fluoro-pyridine

Show more names

PCA99203AKOS006311938Pyridine, 4-(bromomethyl)-2-fluoro-BS-53360SY232376DB-106132EN300-253148F88087

Database identifiers

CAS: 64992-03-6
PubChem CID: 13985168
EC Number: 972-494-4

Properties

Computed structural properties

XLogP: 1.8
Topological polar surface area: 12.9 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 2
Rotatable bonds: 1
Heavy atoms: 9
Formal charge: 0
Complexity: 89.1

Physicochemical properties

Boiling point: 232.9 · 232.9±25.0 °C(Predicted)
Density: 1.632 · 1.632±0.06 g/cm3(Predicted)
pka: -0.84 · -0.84±0.10(Predicted)
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 302 · H302-H315-H319-H335
Precautionary statements: 280 · P280-P305+P351+P338

Safety & regulation

GHS classification

GHS Classification · 4 items

Danger

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P260, P264, P270, P280, P301+P317, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P330, P363, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.