2-Methyl-5-nitrophenyl isocyanate
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Grundinformationen
- CAS
13471-68-6- Standard-SMILES
Cc1ccc([N+](=O)[O-])cc1N=C=O- InChIKey
PQFOUIMVTGBFRN-UHFFFAOYSA-N- Summenformel
- C8H6N2O3
- Durchschnittliche Molmasse
- 178,14 g/mol
- Monoisotopische Masse
- 178,03784206
Namen und Bezeichner
- Bevorzugter Name
- 2-Methyl-5-nitrophenyl isocyanate
- IUPAC
- 2-isocyanato-1-methyl-4-nitrobenzene
- Englischer Name
- 2-Methyl-5-nitrophenyl isocyanate
- Summenformel
- C8H6N2O3
- Molmasse
- 178.15
Namen und Synonyme
2-Methyl-5-nitrophenyl isocyanateBenzene, 2-isocyanato-1-methyl-4-nitro-DTXSID10303473RefChem:88184DTXCID80254605624-028-3PQFOUIMVTGBFRN-UHFFFAOYSA-N13471-68-62-isocyanato-1-methyl-4-nitrobenzene2-methyl-5-nitrophenylisocyanateMFCD000147182-isocyanato-1-methyl-4-nitro-benzene
Weitere Namen anzeigen
2-methyl-5-isocyanatonitrobenzene2-Methyl-5-nitrophenylisocyanante2-Methyl-5-nitrophenyl isocyanate-97%
NSC158457SCHEMBL3743892-methyl-5-nitrobenzenisocyanateAKOS009157294AKOS015889414NSC-1584572-Methyl-5-nitrophenyl isocyanate, 98%AS-85591
Datenbank-Bezeichner
- CAS
13471-68-6- PubChem CID
- 292609
- DTXSID
DTXSID10303473- EC Number
- 624-028-3
- Nikkaji
- J266.763K
Eigenschaften
Berechnete StruktureigenschaftenWird ergänzt
- XLogP
- 3,4
- Polarare Oberfläche (TPSA)
- 75,3 Ų
- H-Brücken-Donoren
- 0
- H-Brücken-Akzeptoren
- 4
- Frei drehbare Bindungen
- 1
- Schwere Atome
- 13
- Formalladung
- 0
- Komplexität
- 242
Physikochemische Eigenschaften
- Schmelzpunkt
- 49 · 49-52 °C(lit.)
- Siedepunkt
- 299.4 · 299.4±28.0 °C(Predicted)
- Dichte
- 1.27 · 1.27±0.1 g/cm3(Predicted)
- Flammpunkt
- 230 °F · >230 °F
- BRN
- 3272007 · 3272007
Sicherheit und Regulatorisches
Sicherheitsangaben dienen nur zur Orientierung und ersetzen weder das Sicherheitsdatenblatt (SDB) des Lieferanten noch geltende Vorschriften oder eine fachliche Bewertung.
GHS-Klassifizierung
GHS Classification
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 (11.6%): 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 43 reports by companies from 3 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 (11.6%)；STOT SE 3 (100%)
Sicherheitsdaten
- wgk
- 3
- ridadr
- 2811
- risk_code
- 20/21/22-36/37/38
- hazard_code
Chemie und Industrie
Anwendungen
Verwenden2-Isocyanato-1-methyl-4-nitrobenzene is a useful building block for organic synthesis and a pharmaceutical intermediate.
Anbieter30 Anbieter
上海衡新化工科技有限公司13917104483; 13917104483 · [email protected]
河南赢创生物科技有限公司16650615803 · [email protected]
上海仲因实业有限公司2537653158 16621191650 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
阿法埃莎（中国）化学有限公司400-6106006 · [email protected]
上海瀚鸿科技股份有限公司021-54306202 13764082696 · [email protected]
上海相辉医药科技有限公司13761987713; 13761987713 · [email protected]
河南伊诺凯新材料有限公司13290191024 13290191024 · [email protected]
普善实业（陕西）有限公司029-81310890 18165209495 · [email protected]
成都瑞欧克科技有限公司028-64353063 · [email protected]
湖北恒绿源科技有限公司027-88188016 18717196322 · [email protected]
山东利腾生物科技有限公司15020019777 18663721413 · [email protected]
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