3-Fluorobenzyl isocyanate

HCID 643499

Grundinformationen

CAS
102422-56-0
Standard-SMILES
O=C=NCc1cccc(F)c1
InChIKey
PHRJTGPFEAUEBC-UHFFFAOYSA-N
Summenformel
C8H6FNO
Durchschnittliche Molmasse
151,14 g/mol
Monoisotopische Masse
151,04334198

Namen und Bezeichner

Bevorzugter Name
3-Fluorobenzyl isocyanate
IUPAC
1-fluoro-3-(isocyanatomethyl)benzene
Englischer Name
3-Fluorobenzyl isocyanate
Summenformel
C8H6FNO
Molmasse
151.14

Namen und Synonyme

3-Fluorobenzyl isocyanate102422-56-01-fluoro-3-(isocyanatomethyl)benzenebenzene, 1-fluoro-3-(isocyanatomethyl)-DTXSID60349200RefChem:501948DTXCID80300272627-796-8InChI=1/C8H6FNO/c9-8-3-1-2-7(4-8)5-10-6-11/h1-4H,5H3-FLUOROBENZylisoCYANATEMFCD020936923-fluoro-benzyl isocyanate
Weitere Namen anzeigen
516554_ALDRICH3-Fluorobenzyl isocyanate 98%
SCHEMBL52633-fluorophenylmethyl isocyanateSCHEMBL28761119SCHEMBL314729433-Fluorobenzyl isocyanate, 98%PHRJTGPFEAUEBC-UHFFFAOYSA-N1-fluoro-3-isocyanatomethylbenzeneALBB-007565

Datenbank-Bezeichner

CAS
102422-56-0
PubChem CID
643499
DTXSID
DTXSID60349200
EC Number
627-796-8

Eigenschaften

Berechnete Struktureigenschaften

XLogP
3,1
Polarare Oberfläche (TPSA)
29,4 Ų
H-Brücken-Donoren
0
H-Brücken-Akzeptoren
3
Frei drehbare Bindungen
2
Schwere Atome
11

Physikochemische Eigenschaften

Siedepunkt
209 °C · 209 °C (lit.)
Dichte
1.09 · 1.09±0.1 g/cm3(Predicted)
Brechungsindex
20 · n20/D 1.506(lit.)
Flammpunkt
195 °F · 195 °F
storage temp.
2 · 2-8°C
Aggregatzustand
Liquid

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Danger

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];H334 (100%): May cause allergy or asthma symptoms or breathing difficulties if inhaled [Danger Sensitization, respiratory];H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P233, P260, P261, P264, P264+P265, P270, P271, P280, P284, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P342+P316, P362+P364, P403, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 39 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.;Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

Gefahrenhinweise

Hazard Classes and CategoriesAcute Tox. 4 (100%);Acute Tox. 4 (100%);Skin Irrit. 2 (100%);Eye Irrit. 2 (100%);Acute Tox. 4 (100%);Resp. Sens. 1 (100%);STOT SE 3 (100%)

Sicherheitsdaten

wgk
3
ridadr
UN 3080 6.1/PG 2
risk_code
20/21/22-36/37/38
hazard_code
Xn
safety_code
26-36/37/39
hazard_class
IRRITANT

Chemie und Industrie

Anbieter19 Anbieter

Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
安耐吉化学&3A(安徽泽升科技股份有限公司)400-0056266 · [email protected]
Allfluoro Pharmaceutical Company Limited+86-400-0216110 +86-15958047586 · [email protected]
梯希爱(上海)化工贸易有限公司021-61109150 · [email protected]

Zugehörige Reaktionen

28

Notizen zur Verbindung

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