2,2-dimethyl-3,4-dihydro-2H-1,4-benzoxazine
Grundinformationen
- CAS
866089-28-3- Standard-SMILES
CC1(C)CNc2ccccc2O1- InChIKey
WILBVUMFTFLAHJ-UHFFFAOYSA-N- Summenformel
- C10H13NO
- Durchschnittliche Molmasse
- 163,22 g/mol
Namen und Bezeichner
- Bevorzugter Name
- 2,2-dimethyl-3,4-dihydro-2H-1,4-benzoxazine
- IUPAC
- 2,2-dimethyl-3,4-dihydro-1,4-benzoxazine
- Englischer Name
- 2,2-DiMethyl-3,4-dihydro-2H-1,4-benzoxazine, 97%
- Summenformel
- C10H13NO
- Molmasse
- 163.22
Namen und Synonyme
866089-28-32,2-dimethyl-3,4-dihydro-2H-1,4-benzoxazineRefChem:441291874-467-12,2-dimethyl-3,4-dihydro-2h-benzo[b][1,4]oxazineMFCD116034192,2-DIMETHYL-3,4-DIHYDRO-1,4-BENZOXAZINE3,4-Dihydro-2,2-dimethyl-2H-1,4-benzoxazine2,2-DiMethyl-3,4-dihydro-2H-1,4-benzoxazine, 97%2H-1,4-Benzoxazine, 3,4-dihydro-2,2-dimethyl-SCHEMBL1036714SCHEMBL1555141
Weitere Namen anzeigen
2,2-Dimethyl-3,4-dihydro-2H-1,4-benzoxazine,97%
SCHEMBL2917773SCHEMBL30303079WILBVUMFTFLAHJ-UHFFFAOYSA-NRJB08928AKOS006316615AB64324AS-67954SY035443
Datenbank-Bezeichner
- CAS
866089-28-3- PubChem CID
- 23587101
- EC Number
- 874-467-1
- Nikkaji
- J1.875.137B
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 2,3
- Polarare Oberfläche (TPSA)
- 21,3 Ų
- H-Brücken-Donoren
- 1
- H-Brücken-Akzeptoren
- 2
- Frei drehbare Bindungen
- 0
- Schwere Atome
- 12
- Formalladung
- 0
- Komplexität
- 167
Physikochemische Eigenschaften
- Siedepunkt
- 254.8 · 254.8±20.0 °C(Predicted)
- Dichte
- 1.009 · 1.009±0.06 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C, protect from light
- pka
- 4.45 · 4.45±0.40(Predicted)
- Aggregatzustand
- solid
- InChI
- 1S/C10H13NO/c1-10(2)7-11-8-5-3-4-6-9(8)12-10/h3-6,11H,7H2,1-2H3
- InChIKey
- WILBVUMFTFLAHJ-UHFFFAOYSA-N
- SMILES
- CC1(C)CNC2=CC=CC=C2O1
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
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, 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 CategoriesSkin Irrit. 2 (100%)
Sicherheitsdaten
- wgk
- WGK 3
- hs_code
- 2934999090
- risk_code
- 22
- hazard_code
- Xn
- Speicherklasse
- 11 - Combustible Solids
- Hazard Classifications
- Acute Tox. 4 Oral
Chemie und Industrie
Anwendungen
VerwendenIt possess various biological activities.
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