Grundinformationen
- Standard-SMILES
C=C(Cl)C#N- InChIKey
OYUNTGBISCIYPW-UHFFFAOYSA-N- Summenformel
- C3H2ClN
- Durchschnittliche Molmasse
- 87,51 g/mol
- Monoisotopische Masse
- 86,98757674
Überblick
2-chloroacrylonitrile appears as a liquid. Boiling point 190-192 °F (88-89 °C). Density 1.096 g / cm3. Flash point 44 °F. Highly toxic.
Namen und Bezeichner
- Bevorzugter Name
- 2-Chloroacrylonitrile
- IUPAC
- 2-chloroprop-2-enenitrile
- Lokaler Name
- 2-Chloracrylonitril
- Englischer Name
- 2-Chloroacrylonitrile
- Summenformel
- C3H2ClN
- Molmasse
- 87.51
Namen und Synonyme
Weitere Namen anzeigen
Datenbank-Bezeichner
- CAS
920-37-6- PubChem CID
- 70198
- DTXSID
DTXSID6052613- UNII
- FFJ1QHD154
- EC Number
- 213-055-2
- Nikkaji
- J55.139B
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 1,4
- Polarare Oberfläche (TPSA)
- 23,8 Ų
- H-Brücken-Donoren
- 0
- H-Brücken-Akzeptoren
- 1
- Frei drehbare Bindungen
- 0
- Schwere Atome
- 5
- Formalladung
- 0
- Komplexität
- 86,3
Experimentelle und physikochemische Eigenschaften
Flash Point
44 °F (NTP, 1992)
44 °F
Physical Description
2-chloroacrylonitrile appears as a liquid. Boiling point 190-192 °F (88-89 °C). Density 1.096 g / cm3. Flash point 44 °F. Highly toxic.
Highly toxic liquid with boiling point of 88-89 deg C; [CAMEO]
Physikochemische Eigenschaften
- Schmelzpunkt
- 65 °C · −65 °C(lit.)
- Siedepunkt
- 88 · 88-89 °C(lit.)
- Dichte
- 1.096 g/mL · 1.096 g/mL at 25 °C(lit.)
- Brechungsindex
- 20 · n20/D 1.429(lit.)
- Flammpunkt
- 44 °F · 44 °F
- storage temp.
- 2 · Inert atmosphere,2-8°C
- Löslichkeit
- Chloroform, Ethyl Acetate, Methanol (Very Slightly)
- Aggregatzustand
- Liquid
- Farbe
- Clear colorless to yellow
- BRN
- 773744 · 773744
- InChI
- InChI=1S/C3H2ClN/c1-3(4)2-5/h1H2
- InChIKey
- OYUNTGBISCIYPW-UHFFFAOYSA-N
- SMILES
- C(#N)C(Cl)=C
- CAS Datenbank
- 920 · 920-37-6(CAS DataBase Reference)
- NIST chemische Informationen
- 2 · 2-Propenenitrile, 2-chloro-(920-37-6)
- EPA chemische Informationen
- 2 · 2-Chloroacrylonitrile (920-37-6)
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
Danger
H225 (100%): Highly Flammable liquid and vapor [Danger Flammable liquids]
P203, P210, P233, P240, P241, P242, P243, P260, P262, P264, P270, P271, P273, P280, P284, P301+P316, P301+P330+P331, P302+P352, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P318, P320, P321, P330, P342+P316, P361+P364, P363, P370+P378, P391, P403, P403+P233, P403+P235, 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.
Gefahrenhinweise
Sicherheit und Schutzausrüstung
First Aid
EYES: First check the victim for contact lenses and remove if present. Flush victim's eyes with water or normal saline solution for 20 to 30 minutes while simultaneously calling a hospital or poison control center. Do not put any ointments, oils, or medication in the victim's eyes without specific instructions from a physician. IMMEDIATELY transport the victim after flushing eyes to a hospital even if no symptoms (such as redness or irritation) develop.
Toxikologische Informationen
Sicherheitsdaten
- wgk
- 3
- tsca
- TSCA listed
- ridadr
- UN 3383 6.1/PG 1
- hs_code
- 29269095
- RTECS-Nr.
- AT5525000
- risk_code
- 45-24-26/28-34-43-50-40-36/37/38-28-23/24-11
- hazard_code
- F,T+,T,N
- hazard_note
- Flammable/Very Toxic
- safety_code
- 53-26-36/37/39-45-61-28A-16-1-28
- hazard_class
- 3.1
- packing_group
- II
Chemie und Industrie
Verwendung und Herstellung
Anwendungen
Verwenden2-Chloroacrylonitrile (cas# 920-37-6) is a compound useful in organic synthesis.
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