1-(2-Fluorophenyl)piperazine (HCID 70529)

Names & identifiers

Preferred name: 1-(2-Fluorophenyl)piperazine
IUPAC: 1-(2-fluorophenyl)piperazine
English name: 1-(2-Fluorophenyl)piperazine
Molecular formula: C10H13FN2
Molecular weight: 180.22

Names & synonyms

1-(2-Fluorophenyl)piperazine1011-15-0EINECS 213-780-4DTXSID30143732RefChem:422125DTXCID7066223213-780-4Piperazine, 1-(2-fluorophenyl)-1-(2-Fluorophenyl)-piperazineMFCD000407261-(2-Fluoro-phenyl)-piperazineCHEMBL9429

Show more names

1-(o-Fluorophenyl)piperazineAKOS BBS-000036154-(95-Butyl)phenolRARECHEM AH CK 0103LABOTEST-BB LT001593661-(2-Fluorphenyl)-piperazineN-(2-Fluorophenyl)piperazine2-(1-Piperazino)fluorobenzene

(2-fluorophenyl)piperazine4-(2-Fluorophenyl)piperazineoFPP2-fluorophenylpiperazine2-Fluorophenyl piperazine4-(fluorophenyl)piperazineortho-fluorophenylpiperazine1-(2-flurophenyl)piperazine

Database identifiers

CAS: 1011-15-0
PubChem CID: 70529
DTXSID: DTXSID30143732
ChEMBL: CHEMBL9429
EC Number: 213-780-4
Nikkaji: J217.128G

Properties

Computed structural properties

XLogP: 1.5
Topological polar surface area: 15.3 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 3
Rotatable bonds: 1
Heavy atoms: 13
Formal charge: 0
Complexity: 157

Experimental & physicochemical properties

Drugs · 2 items

DEA NFLIS-Drug Category -> Piperazines (Hallucinogen)

Pharmaceuticals -> Synthetic Cannabinoids or Psychoactive Compounds

Physicochemical properties

Melting point: 44 · 44-48℃
Boiling point: 150 °C/3 · 150 °C/3 mmHg (lit.)
Density: 1.141 g/mL · 1.141 g/mL at 25 °C (lit.)
refractive index: 20 · n20/D 1.556(lit.)
Flash point: 230 °F · >230 °F
storage temp.: 2 · Storage temp. 2-8°C
solubility: DMSO (Slightly, Heated), Methanol (Slightly)
form: Liquid
pka: 8.78 · 8.78±0.10(Predicted)
color: Clear colorless to light yellow
Sensitive: Air Sensitive
BRN: 611787 · 611787
InChI: 1S/C10H13FN2/c11-9-3-1-2-4-10(9)13-7-5-12-6-8-13/h1-4,12H,5-8H2
InChIKey: IVTZRJKKXSKXKO-UHFFFAOYSA-N
SMILES: Fc1ccccc1N2CCNCC2
CAS DataBase Reference: 1011 · 1011-15-0(CAS DataBase Reference)
UNSPSC Code: 12352100 · 12352100
NACRES: 22 · NA.22
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 302 · H302+H312+H332-H315-H319-H335
Precautionary statements: 261 · P261-P280-P301+P312-P302+P352+P312-P304+P340+P312-P305+P351+P338
target organs: Respiratory system
PPE: Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
Hazard Codes: Xn,T,Xi
Risk Statements: 20 · 20/21/22-36/37/38
Safety Statements: 26 · 26-36-24/25
RIDADR: 2923 · 2923
WGK Germany: 3 · 3
Hazard Note: Toxic
HazardClass: 8 · 8
PackingGroup: II
HS Code: 29349990 · 29349990
Storage Class: 10 · 10 - Combustible liquids
Hazard Classifications: 4 OralEye · Acute Tox. 4 OralEye Irrit. 2Skin Irrit. 2STOT SE 3

Safety & regulation

GHS classification

GHS Classification · 4 items

Danger

H301 (10.9%): Toxic if swallowed [Danger Acute toxicity, oral]

P260, P261, P264, P264+P265, P270, P271, P280, P301+P316, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P351+P338, P305+P354+P338, P316, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P363, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 46 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazard Classes and CategoriesAcute Tox. 3 (10.9%)

Safety data

PPE: Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
wgk: 3
ridadr: 2923
hs_code: 29349990
risk_code: 20/21/22-36/37/38
Signal word: Warning
Symbol(GHS): GHS07
hazard_code: Xn,T,Xi
hazard_note: Toxic
safety_code: 26-36-24/25
hazard_class: 8
Storage Class: 10 - Combustible liquids
packing_group: II
target organs: Respiratory system
Hazard statements: H302+H312+H332-H315-H319-H335
Hazard Classifications: Acute Tox. 4 OralEye Irrit. 2Skin Irrit. 2STOT SE 3
Precautionary statements: P261-P280-P301+P312-P302+P352+P312-P304+P340+P312-P305+P351+P338