1-Benzylpyrrol

1H-Pyrrole, 1-(phenylmethyl)-

HCID 74922CAS 2051-97-0
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Grundinformationen

Standard-SMILES
c1ccc(Cn2cccc2)cc1
InChIKey
FNEQHKCQXDKYEO-UHFFFAOYSA-N
Summenformel
C11H11N
Durchschnittliche Molmasse
157,21 g/mol
Monoisotopische Masse
157,08914936

Namen und Bezeichner

Bevorzugter Name
1H-Pyrrole, 1-(phenylmethyl)-
IUPAC
1-benzylpyrrole
Lokaler Name
1-Benzylpyrrol
Englischer Name
1-BENZYLPYRROLE
Summenformel
C11H11N
Molmasse
157.21

Namen und Synonyme

1-BenzylpyrroleN-Benzylpyrrole1H-Pyrrole, 1-(phenylmethyl)-Pyrrole, 1-benzyl-NSC 4024EINECS 218-137-1NSC 116806DTXSID3062150RefChem:439162Pyrrole, 1-benzyl-(8CI)DTXCID6036330218-137-1
Weitere Namen anzeigen
1-Benzylpyrrole >N-Benzylpyrrole, 97%1-(phenylmethyl)pyrrole1-(phenylmethyl)-1h-pyrrol
2051-97-01-Benzyl-1H-pyrroleMFCD00963301NSC-4024NSC-1168061-benzylpyrrolFK5VAY3WJPN-Benzylpyrrole, 97%

Datenbank-Bezeichner

CAS
2051-97-0
PubChem CID
74922
DTXSID
DTXSID3062150
ChEMBL
CHEMBL259946
UNII
FK5VAY3WJP
EC Number
218-137-1
Nikkaji
J94.944B

Eigenschaften

Berechnete Struktureigenschaften

XLogP
2,7
Polarare Oberfläche (TPSA)
4,9 Ų
H-Brücken-Donoren
0
H-Brücken-Akzeptoren
0
Frei drehbare Bindungen
2
Schwere Atome
12

Physikochemische Eigenschaften

Schmelzpunkt
15 °C · 15 °C
Siedepunkt
90 °C0.9 · 90 °C0.9 mm Hg(lit.)
Dichte
1.03 · 1.03
Brechungsindex
20 · n20/D 1.5685(lit.)
Flammpunkt
115 °F · 115 °F
Aggregatzustand
Liquid

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Warning

H315 (97.5%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (97.5%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (97.5%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract 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)

Aggregated GHS information provided per 40 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

Regulatory InformationChemical: 1H-Pyrrole, 1-(phenylmethyl)-
Other Safety InformationEvaluation - Chemicals not considered for in depth evaluation - Not commercially active in Australia
Hazard Classes and CategoriesSkin Irrit. 2 (97.5%)；Eye Irrit. 2 (97.5%)；STOT SE 3 (97.5%)

Regulatorische Informationen

Regulatory InformationChemical: 1H-Pyrrole, 1-(phenylmethyl)-

Sicherheitsdaten

wgk
3
tsca
TSCA listed
ridadr
UN 1993 3/PG 3
hs_code
2933998090
risk_code
10-36/37/38
hazard_code
Xi

Chemie und Industrie

Verwendung und Herstellung

General Manufacturing Information1H-Pyrrole, 1-(phenylmethyl)-: INACTIVE
Anwendungen · 1 Eintrag

VerwendenN-benzylpyrrole may be used in the synthesis of the following:(E,Z)-3-(7,8-dimethoxy-5H-pyrrolo[2,1-a]isoindol-3-yl)-N,N-diethylacrylamide(E,Z)-7,8-dimethoxy-3-styryl-5H-pyrrolo[2,1-a]isoindolepyrroloisoquinolines(Z)-2-(7,8-dimethoxypyrrolo[1,2-b]isoquinolin-10-ylidene)-N,N-diethylacetamide(E,Z)-10-benzylidene-7,8-dimethoxy-5,10-dihydropyrrolo- [1,2-b]isoquinoline(E,Z)-7,8-dimethoxy-10-(2-methoxyvinyl)-5,10-dihydropyrrolo[1,2-b]isoquinoline(Z)-7,8-dimethoxy-10-(methoxymethylene)-5,10-dihydropyrrolo[1,2-b]isoquinoline2-cyano-N-benzylpyrroles3-cyano-N-benzylpyrroles

Vor- und nachgelagerte Produkte

Anbieter50 Anbieter

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
阿诺西（上海）生物技术有限公司400-1107768 15058188853 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
北京福源坊科技有限公司010-57903446 15869909019 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]

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