CAS 85983-56-8 3-Fluoro-4-(piperidin-1-yl)aniline (HCID 6485758)

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Basic information

CAS: 85983-56-8
Standard SMILES: Nc1ccc(N2CCCCC2)c(F)c1
InChIKey: QBVOAZVDLKSGLR-UHFFFAOYSA-N
Molecular formula: C11H15FN2
Average molar mass: 194.25 g/mol
Monoisotopic mass: 194.1219267

Names & identifiers

Preferred name: 3-Fluoro-4-(piperidin-1-yl)aniline
IUPAC: 3-fluoro-4-piperidin-1-ylaniline
English name: 3-FLUORO-4-PIPERIDIN-1-YL-PHENYLAMINE
Molecular formula: C11H15FN2
Molecular weight: 194.25

Names & synonyms

3-fluoro-4-(piperidin-1-yl)anilineRefChem:501728848-123-685983-56-83-Fluoro-4-piperidin-1-yl-phenylamine3-fluoro-4-piperidin-1-ylanilineMFCD078012013-fluoro-4-piperidylphenylamine3-fluoro-4-piperidin-1-ylaniline dihydrochloride3-fluoro-4-piperidinoanilineSCHEMBL157935SCHEMBL28901605

Show more names

AKOS BB373AKOS B033505TIMTEC-BB SBB010917Benzenamine, 3-fluoro-4-(1-piperidinyl)-

SCHEMBL30721891DTXSID60424541QBVOAZVDLKSGLR-UHFFFAOYSA-N3-fluoro-4-(1-piperidyl)anilineALBB-0132703-fluoro-4-(1-piperidinyl)AnilineSBB010917STK346982

Database identifiers

CAS: 85983-56-8
PubChem CID: 6485758
DTXSID: DTXSID60424541
EC Number: 848-123-6

Properties

Computed structural properties

XLogP: 2.3
Topological polar surface area: 29.3 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 3
Rotatable bonds: 1
Heavy atoms: 14
Formal charge: 0
Complexity: 180

Physicochemical properties

storage temp.: 2 · 2-8°C(protect from light)
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 302 · H302-H315-H319-H335
Precautionary statements: 261 · P261-P305+P351+P338
Hazard Codes: Xi
HazardClass: IRRITANT

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

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

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, 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.