1-[2-Nitro-4-(trifluoromethyl)phenyl]piperazine

HCID 2771407CAS 58315-38-1
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Grundinformationen

Standard-SMILES
O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CCNCC1
InChIKey
YOBUPGXTLFRIJD-UHFFFAOYSA-N
Summenformel
C11H12F3N3O2
Durchschnittliche Molmasse
275,23 g/mol
Monoisotopische Masse
275,08816112

Namen und Bezeichner

Bevorzugter Name
1-[2-Nitro-4-(trifluoromethyl)phenyl]piperazine
IUPAC
1-[2-nitro-4-(trifluoromethyl)phenyl]piperazine
Englischer Name
N-[2-NITRO-4-(TRIFLUOROMETHYL)PHENYL]PIPERAZINE
Summenformel
C11H12F3N3O2
Molmasse
275.23

Namen und Synonyme

58315-38-11-[2-nitro-4-(trifluoromethyl)phenyl]piperazineN-[2-Nitro-4-(trifluoromethyl)phenyl]piperazineMFCD000526131-(2-Nitro-4-trifluoromethylphenyl)-piperazine[2-nitro-4-(trifluoromethyl)phenyl]piperazine1-(2-Nitro-4-(trifluoromethyl)phenyl)piperazinen-(2-nitro-4-(trifluoromethyl)phenyl)piperazine1-(2-Nitro-4-trifluoromethyl-phenyl)-piperazineSCHEMBL615409Piperazine,1-[2-nitro-4-(trifluoromethyl)phenyl]-orb1689769
Weitere Namen anzeigen
BUTTPARK 34\09-11CBI-BB ZERO/006279Nitrotrifluoromethylphenylpiperazine3-NITRO-4-(1-PIPERAZINYL)BENZOTRIFLUORIDE3-Nitro-4-(piperazin-1-yl)BenzotrifluoridePiperazine, 1-[2-nitro-4-(trifluoromethyl)phenyl]-N-[2-Nitro-4-(trifluoromethyl)phenyl]piperazine97%N-[2-Nitro-4-(trifluoromethyl)phenyl]piperazine 97%
SCHEMBL3551777SCHEMBL30148162DTXSID10377937VHHZVCJGPKXDIC-UHFFFAOYSA-NBBL002982SBB013997STK013417AKOS000288825

Datenbank-Bezeichner

CAS
58315-38-1
PubChem CID
2771407
DTXSID
DTXSID10377937
EC Number
671-961-7
Nikkaji
J267.373H

Eigenschaften

Berechnete Struktureigenschaften

XLogP
2,1
Polarare Oberfläche (TPSA)
61,1 Ų
H-Brücken-Donoren
1
H-Brücken-Akzeptoren
7
Frei drehbare Bindungen
1
Schwere Atome
19

Physikochemische Eigenschaften

Schmelzpunkt
65 °C · 65 °C
Siedepunkt
370 · 370.0±42.0 °C(Predicted)
Dichte
1.355 · 1.355±0.06 g/cm3(Predicted)
pka
8.58 · 8.58±0.10(Predicted)
Aggregatzustand
powder
Farbe
Orange

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H312 (100%): Harmful in contact with skin [Warning Acute toxicity, dermal]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H332 (100%): Harmful if inhaled [Warning Acute toxicity, inhalation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

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

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Gefahrenhinweise

Hazard Classes and CategoriesAcute Tox. 4 (100%)；Acute Tox. 4 (100%)；Skin Irrit. 2 (100%)；Eye Irrit. 2 (100%)；Acute Tox. 4 (100%)；STOT SE 3 (100%)

Sicherheitsdaten

hs_code
2933599590
risk_code
36/37/38
hazard_code
Xi
hazard_note
Irritant
safety_code
26-36/37/39

Chemie und Industrie

Anbieter20 Anbieter

南京世洲生物科技有限公司025-025-85560043 17301488900 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
武汉凯威斯科技有限公司86-027-67849912 · [email protected]
广东方信生物科技有限公司0751-2838688 13376594225 · [email protected]
江苏艾康生物医药研发有限公司025-5885952 15955137747 · [email protected]

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