Grundinformationen
- Standard-SMILES
[C-]#[N+]C(Cc1ccccc1)C(=O)OC- InChIKey
CEPQFHINGYLWCQ-UHFFFAOYSA-N- Summenformel
- C11H11NO2
- Durchschnittliche Molmasse
- 189,21 g/mol
- Monoisotopische Masse
- 189,07897859
Namen und Bezeichner
- Bevorzugter Name
- Methyl 2-isocyano-3-phenylpropanoate
- IUPAC
- methyl 2-isocyano-3-phenylpropanoate
- Englischer Name
- 2-Isocyano-3-phenylpropionic acid methyl ester
- Summenformel
- C11H11NO2
- Molmasse
- 189.21
Namen und Synonyme
methyl 2-isocyano-3-phenylpropanoateRefChem:814489896-543-32-Isocyano-3-phenylpropionic acid methyl ester63157-14-2112790-04-2SCHEMBL1274306DTXSID30370501CEPQFHINGYLWCQ-UHFFFAOYSA-NMethyl 2-isocyano-3-phenylpropionateGS-03262-Isocyano-3-phenyl-propionic acid methyl ester
Weitere Namen anzeigen
Methyl 2-isocyano-3-phenylpropionate,96%
EN300-8616014Methyl 2-isocyano-3-phenylpropanoate, AldrichCPR
Datenbank-Bezeichner
- CAS
63157-14-2- PubChem CID
- 2734779
- DTXSID
DTXSID30370501- EC Number
- 896-543-3
- Nikkaji
- J845.111G
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 2
- Polarare Oberfläche (TPSA)
- 30,7 Ų
- H-Brücken-Donoren
- 0
- H-Brücken-Akzeptoren
- 3
- Frei drehbare Bindungen
- 4
- Schwere Atome
- 14
- Formalladung
- 0
- Komplexität
- 235
Physikochemische Eigenschaften
- Schmelzpunkt
- 40 · 40-46 °C
- storage temp.
- Refrigerator (+4°C)
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
Danger
H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]；H311 (100%): Toxic in contact with skin [Danger Acute toxicity, dermal]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H331 (100%): Toxic if inhaled [Danger Acute toxicity, inhalation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
P261, P262, P264, P264+P265, P270, P271, P280, P301+P316, P302+P352, P304+P340, P305+P351+P338, P316, P319, P321, P330, P332+P317, P337+P317, P361+P364, 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. 3 (100%)；Acute Tox. 3 (100%)；Skin Irrit. 2 (100%)；Eye Irrit. 2A (100%)；Acute Tox. 3 (100%)；STOT SE 3 (100%)
Sicherheitsdaten
- hs_code
- 29299000
- risk_code
- 36/37/38-20/21/22
- hazard_code
- Xn
- safety_code
- 36/37/39-26
Chemie und Industrie
Anbieter4 Anbieter
Aladdin Scientific[email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
Alfa Chemistry+1-5166625404 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
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