Dibenzylamin

Dibenzylamine

HCID 7656CAS 103-49-1
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Grundinformationen

Standard-SMILES
c1ccc(CNCc2ccccc2)cc1
InChIKey
BWLUMTFWVZZZND-UHFFFAOYSA-N
Summenformel
C14H15N
Durchschnittliche Molmasse
197,27 g/mol
Monoisotopische Masse
197,12044948

Namen und Bezeichner

Bevorzugter Name
Dibenzylamine
IUPAC
N-benzyl-1-phenylmethanamine
Lokaler Name
Dibenzylamin
Englischer Name
Dibenzylamine
Summenformel
C14H15N
Molmasse
197.28

Namen und Synonyme

Dibenzylamine103-49-1Benzenemethanamine, N-(phenylmethyl)-BibenzylamineN-(Phenylmethyl)benzenemethanamineDTXSID60443553G0YFX01C6NSC-4811DTXCID4024355RefChem:132868203-117-7N-benzyl-1-phenylmethanamine
Weitere Namen anzeigen
Accelerator DBADBZADIBAMVulcaid 28forLabetalol
N,N-DibenzylamineN-BenzylbenzylaminebisbenzylamineDIBENZYL-AMINE(N-Benzylaminomethyl)benzeneMFCD00004770NSC 4811N,N-Dibenylamine

Datenbank-Bezeichner

CAS
103-49-1
PubChem CID
7656
DTXSID
DTXSID6044355
ChEMBL
CHEMBL3182419
ChEBI
CHEBI:189125
UNII
3G0YFX01C6
EC Number
203-117-7
Nikkaji
J37.741D

Eigenschaften

Berechnete Struktureigenschaften

XLogP
2,7
Polarare Oberfläche (TPSA)
12 Ų
H-Brücken-Donoren
1
H-Brücken-Akzeptoren
1
Frei drehbare Bindungen
4
Schwere Atome
15

Experimentelle und physikochemische Eigenschaften

Vapor Pressure0.00026 [mmHg]
Physical DescriptionLiquid with an ammoniacal odor; [Merck Index] Colorless liquid with a weak odor; [Alfa Aesar MSDS]
Ionization Efficiency · 6 Einträge

Positive

5

2.7

Agilent XCT

Electrospray ionization

formic acid (5.3nM)

Kovats Retention Index · 2 Einträge

1688.9；1670

2427；2473；2473

Collision Cross Section149.6 Ų [M+H]+ [CCS Type: DT; Buffer gas: N2; Ionization: ESI+; Dataset: TOXCAST; Source Identifier: DTXSID6044355]；150.8 Ų [M+H]+ [CCS Type: DT; Buffer gas: N2; Ionization: APCI+; Dataset: TOXCAST; Source Identifier: DTXSID6044355]

Physikochemische Eigenschaften

Schmelzpunkt
-26 °C · -26 °C (lit.)
Siedepunkt
300 °C · 300 °C (lit.)
Dichte
1.026 g/mL · 1.026 g/mL at 25 °C (lit.)
Dampfdruck
1 · 1-1013hPa at 113.1-286℃
Brechungsindex
20 · n20/D 1.574(lit.)
Flammpunkt
290 °F · 290 °F

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Danger

H302 (99.6%): Harmful if swallowed [Warning Acute toxicity, oral]；H314 (75.4%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]；H315 (24.6%): Causes skin irritation [Warning Skin corrosion/irritation]；H318 (42.2%): Causes serious eye damage [Danger Serious eye damage/eye irritation]；H319 (24.6%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H410 (44.1%): Very toxic to aquatic life with long lasting effects [Warning Hazardous to the aquatic environment, long-term hazard]；H412 (18.8%): Harmful to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]

P260, P264, P264+P265, P270, P273, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P351+P338, P305+P354+P338, P316, P317, P321, P330, P332+P317, P337+P317, P362+P364, P363, P391, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 256 reports by companies from 12 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 Information · 4 Einträge

Chemical: Benzenemethanamine, N-(phenylmethyl)-

Benzenemethanamine, N-(phenylmethyl)- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Benzenemethanamine, N-(phenylmethyl)- are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)

Status: Active Update: 14-02-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/11844；Status: Cease Manufacture Update: 06-02-2019 https://echa.europa.eu/registration-dossier/-/registered-dossier/24936；Status: Cease Manufacture Update: 14-03-2013 https://echa.europa.eu/registration-dossier/-/registered-dossier/7229

Dibenzylamine: Does not have an individual approval but may be used under an appropriate group standard

Hazards SummaryCauses burns; Inhalation may cause corrosive injuries to upper respiratory tract and lungs; Harmful by ingestion; [Alfa Aesar MSDS] See Diphenylamine.
Hazard Classes and CategoriesAcute Tox. 4 (99.6%)；Skin Corr. 1C (75.4%)；Skin Irrit. 2 (24.6%)；Eye Dam. 1 (42.2%)；Eye Irrit. 2 (24.6%)；Aquatic Chronic 1 (44.1%)；Aquatic Chronic 3 (18.8%)

Toxikologische Informationen

Adverse EffectsDermatotoxin - Skin burns.；Toxic Pneumonitis - Inflammation of the lungs induced by inhalation of metal fumes or toxic gases and vapors.

Regulatorische Informationen

Regulatory Information · 4 Einträge

Chemical: Benzenemethanamine, N-(phenylmethyl)-

Benzenemethanamine, N-(phenylmethyl)- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Benzenemethanamine, N-(phenylmethyl)- are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)

Status: Active Update: 14-02-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/11844；Status: Cease Manufacture Update: 06-02-2019 https://echa.europa.eu/registration-dossier/-/registered-dossier/24936；Status: Cease Manufacture Update: 14-03-2013 https://echa.europa.eu/registration-dossier/-/registered-dossier/7229

Dibenzylamine: Does not have an individual approval but may be used under an appropriate group standard

Sicherheitsdaten

wgk
3
tsca
TSCA listed
ridadr
2810
hs_code
29214980
risk_code
22-36/38-52/53-34
hazard_code
Xn,Xi,C

Chemie und Industrie

Verwendung und Herstellung

UsesUsed in the detection of cobalt, cyanate, and iron; [Merck Index] Used to make fine chemicals; [ExPub: ECHA REACH Registrations]
U.S. Production2022: 339,051 lb；2020: 523,600 lb
General Manufacturing InformationBenzenemethanamine, N-(phenylmethyl)-: ACTIVE
Anwendungen · 1 Eintrag

VerwendenDibenzylamine is used to prepare rubber accelerator for the vulcanization process and reaction-stoppers. Dibenzylamine type accelerators reduce nitrosamine production in the compounding process. It is also used to produce dibenzyl-nitroso-amine.

Darstellung

synthetischeDibenzylamine is obtained by the reaction of benzyl chloride and liquid ammonia in ethanol.

Vor- und nachgelagerte Produkte

Vorgelagerte Rohstoffe

Anbieter50 Anbieter

国药集团化学试剂有限公司86-21-63210123 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
衢州润东化工有限公司0570-8789886 18892685668 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
山东德信精细化工有限公司18553366272

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