2-Picoline-borane
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Grundinformationen
- CAS
3999-38-0- Standard-SMILES
Cc1ccccn1.[B]- InChIKey
QHXLIQMGIGEHJP-UHFFFAOYSA-N- Summenformel
- C6H7BN
- Durchschnittliche Molmasse
- 103,94 g/mol
- Monoisotopische Masse
- 104,0671544
Namen und Bezeichner
- Bevorzugter Name
- 2-Picoline-borane
- IUPAC
- Boron--2-methylpyridine (1/1)
- Englischer Name
- Borane-2-picoline complex
- Summenformel
- C6H10BN
- Molmasse
- 106.96
Namen und Synonyme
2-picoline-boraneRefChem:4782593999-38-02-Picoline Borane2-Methylpyridine Boranealpha-picoline boranePic-BH32-PicolineboraneTrihydro(2-methylpyridine)-boron2-MethylpyridineboraneB3018picoline borane
Weitere Namen anzeigen
2-Methylpyridine borane complexBorane-2-picoLBORANE - 2-PICOLINE COMPLEX(2-Methylpyridin-1-iuM-1-yl)trihydroborateorane-2-picoline coMplex2- methylpyridine -N- borane2-Methylpyridine - borane (1:1)
a-picoline boraneborane 2-methylpyridine-Picoline-borane adductC6H7BNSCHEMBL140861SCHEMBL29416317DTXSID70462171Boron--2-methylpyridine (1/1)
Datenbank-Bezeichner
- CAS
3999-38-0- PubChem CID
- 11320914
- DTXSID
DTXSID70462171- EC Number
- 609-767-1
Eigenschaften
Berechnete StruktureigenschaftenWird ergänzt
- Polarare Oberfläche (TPSA)
- 12,9 Ų
- H-Brücken-Donoren
- 0
- H-Brücken-Akzeptoren
- 1
- Frei drehbare Bindungen
- 0
- Schwere Atome
- 8
- Formalladung
- 0
- Komplexität
- 52
Physikochemische Eigenschaften
- Schmelzpunkt
- 48 °C · 48 °C
- Dichte
- 1.297 g/mL · 1.297 g/mL at 25 °C
- Flammpunkt
- 100 ° · 100°(212°F)
- storage temp.
- 2 · 2-8°C
- Löslichkeit
- Dichloromethane (Sparingly), Ethyl Acetate (Slightly)
- Aggregatzustand
- Solid
- Farbe
- White
- Wasserlöslichkeit
- Slightly sol. in water, cyclohexane, very sol. in methanol, THF, diglyme, and benzene
- InChI
- InChI=1S/C6H10BN/c1-6-4-2-3-5-8(6)7/h2-5H,1,7H3
- InChIKey
- ZMASBEFBIXMNCP-UHFFFAOYSA-N
- SMILES
- [B+3](N1=CC=CC=C1C)([H-])([H-])[H-]
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
H228 (68.4%): Flammable solid [Danger Flammable solids]；H261 (30.9%): In contact with water releases flammable gas [Danger Substances and mixtures which in contact with water, emit flammable gases]；H301 (68.4%): Toxic if swallowed [Danger Acute toxicity, oral]；H311 (68.4%): Toxic in contact with skin [Danger Acute toxicity, dermal]；H315 (31.6%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (30.9%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H330 (68.4%): Fatal if inhaled [Danger Acute toxicity, inhalation]；H335 (30.9%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
P210, P231+P232, P240, P241, P260, P261, P262, P264, P264+P265, P270, P271, P280, P284, P301+P316, P302+P352, P304+P340, P305+P351+P338, P316, P319, P320, P321, P330, P332+P317, P337+P317, P361+P364, P362+P364, P370+P378, P402+P404, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 152 reports by companies from 8 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 CategoriesFlam. Sol. 1 (68.4%)；Water-react. 2 (30.9%)；Acute Tox. 3 (68.4%)；Acute Tox. 3 (68.4%)；Skin Irrit. 2 (31.6%)；Eye Irrit. 2 (30.9%)；Acute Tox. 1 (68.4%)；STOT SE 3 (30.9%)
Sicherheitsdaten
- wgk
- 3
- ridadr
- UN 3130 6.1(4.3) / PGII
- hs_code
- 29333990
- risk_code
- 14/15-40-36/37/38-26
- hazard_code
- F,Xn,Xi
- safety_code
- 36/37-43-26-36/37/38-14/15
- hazard_class
- 4.3
- packing_group
- II
- Speicherklasse
- 4.3 - Hazardous materials which set free flammable gases upon contact with water
- Hazard Classifications
- Eye Irrit. 2Skin Irrit. 2STOT SE 3Water-react 2
Chemie und Industrie
Anwendungen
VerwendenEnvironmentally benign reducing agent. Reactant for: Reductive amination. N-Benzyl-protection of amino acid derivatives by reductive alkylation. Reductive alkoxyamination.
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