2-Benzylpyrrolidine

HCID 339556CAS 35840-91-6
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Grundinformationen

Standard-SMILES
c1ccc(CC2CCCN2)cc1
InChIKey
NKHMSOXIXROFRU-UHFFFAOYSA-N
Summenformel
C11H15N
Durchschnittliche Molmasse
161,24 g/mol
Monoisotopische Masse
161,12044948

Namen und Bezeichner

Bevorzugter Name
2-Benzylpyrrolidine
IUPAC
2-benzylpyrrolidine
Englischer Name
2-Benzylpyrrolidine
Summenformel
C11H15N
Molmasse
161.24

Namen und Synonyme

2-Benzylpyrrolidine35840-91-6RefChem:465723690-463-0PYRROLIDINE, 2-(PHENYLMETHYL)-MFCD016318392-benzyl-pyrrolidinerac-2-benzylpyrrolidinepyrrolidine, 2-benzyl-rac.-2-benzylpyrrolidineSCHEMBL52608(2RS)-2-benzyl-pyrrolidine
Weitere Namen anzeigen
(S)-2-Benzylpyrrolidine2-Benzylpyrrolidine 98%2-(Phenylmethyl)pyrrolidinealpha-(Pyrrolidin-2-yl)toluene[(Pyrrolidin-2-yl)methyl]benzene
SCHEMBL167190SCHEMBL1036252SCHEMBL6405531SCHEMBL6572638SCHEMBL27335607DTXSID30902624NKHMSOXIXROFRU-UHFFFAOYSA-NAR1052

Datenbank-Bezeichner

CAS
35840-91-6
PubChem CID
339556
DTXSID
DTXSID30902624
EC Number
690-463-0
Nikkaji
J1.724.454J

Eigenschaften

Berechnete Struktureigenschaften

XLogP
2,3
Polarare Oberfläche (TPSA)
12 Ų
H-Brücken-Donoren
1
H-Brücken-Akzeptoren
1
Frei drehbare Bindungen
2
Schwere Atome
12

Physikochemische Eigenschaften

Siedepunkt
96 · 96-97 °C(Press: 2 Torr)
Dichte
0.988 · 0.988±0.06 g/cm3(Predicted)
storage temp.
2 · 2-8°C(protect from light)
pka
1 · pK1: 10.31(+1) (25°C)

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Warning

H302 (66.7%): Harmful if swallowed [Warning Acute toxicity, oral]；H312 (66.7%): 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 (66.7%): Harmful if inhaled [Warning Acute toxicity, inhalation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 3 reports by companies from 2 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 (66.7%)；Acute Tox. 4 (66.7%)；Skin Irrit. 2 (100%)；Eye Irrit. 2 (100%)；Acute Tox. 4 (66.7%)；STOT SE 3 (100%)

Sicherheitsdaten

hs_code
2933998090
risk_code
22
hazard_code
Xi,Xn
hazard_note
Irritant

Chemie und Industrie

Anbieter41 Anbieter

宁波振岳医药科技有限公司19817745290 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
Aladdin Scientific[email protected]
Syntechem Co.,Ltd[email protected]
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]

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