N-Cyclohexyl-2-pyrrolidon

N-Cyclohexyl-2-pyrrolidone

HCID 81278CAS 6837-24-7

Grundinformationen

Standard-SMILES
O=C1CCCN1C1CCCCC1
InChIKey
PZYDAVFRVJXFHS-UHFFFAOYSA-N
Summenformel
C10H17NO
Durchschnittliche Molmasse
167,25 g/mol
Monoisotopische Masse
167,13101417

Namen und Bezeichner

Bevorzugter Name
N-Cyclohexyl-2-pyrrolidone
IUPAC
1-cyclohexylpyrrolidin-2-one
Lokaler Name
N-Cyclohexyl-2-pyrrolidon
Englischer Name
N-Cyclohexyl-2-pyrrolidone
Summenformel
C10H17NO
Molmasse
167.25

Namen und Synonyme

6837-24-71-cyclohexylpyrrolidin-2-oneN-Cyclohexyl-2-pyrrolidone2-Pyrrolidinone, 1-cyclohexyl-N-CyclohexylpyrrolidoneCyclohexyl pyrrolidone7IM8P1VVNMDTXSID7044716DTXCID50247161-cyclohexylpyrrolidoneRefChem:163139229-919-7
Weitere Namen anzeigen
CHPn-cyclohexylSid470pSLC9A1BPCyclohexyl-2-pyrrolidLABOTEST-BB LT00159787Cyclohexyl-2-pyrrolidone
1-Cyclohexyl-2-pyrrolidone1-Cyclohexyl-2-pyrrolidinoneN-CyclohexylpyrrolidinoneUNII-7IM8P1VVNMEINECS 229-919-7MFCD00003191BRN 01218321-cyclohexyl-pyrrolidin-2-one

Datenbank-Bezeichner

CAS
6837-24-7
PubChem CID
81278
DTXSID
DTXSID7044716
ChEMBL
CHEMBL3183929
UNII
7IM8P1VVNM
EC Number
229-919-7
Nikkaji
J150.014G

Eigenschaften

Berechnete Struktureigenschaften

XLogP
1,6
Polarare Oberfläche (TPSA)
20,3 Ų
H-Brücken-Donoren
0
H-Brücken-Akzeptoren
1
Frei drehbare Bindungen
1
Schwere Atome
12

Experimentelle und physikochemische Eigenschaften

Physical Description · 2 Einträge

Liquid

Pale yellow liquid; [Alfa Aesar MSDS]

Collision Cross Section · 1 Eintrag

157.7 Ų [M+Na]+ [CCS Type: DT; Buffer gas: N2; Ionization: ESI+; Dataset: TOXCAST; Source Identifier: DTXSID7044716];140.3 Ų [M+H]+ [CCS Type: DT; Buffer gas: N2; Ionization: ESI+; Dataset: TOXCAST; Source Identifier: DTXSID7044716];139.2 Ų [M+H]+ [CCS Type: DT; Buffer gas: N2; Ionization: APCI+; Dataset: TOXCAST; Source Identifier: DTXSID7044716]

Physikochemische Eigenschaften

Schmelzpunkt
12 °C · 12 °C
Siedepunkt
154 °C7 · 154 °C7 mm Hg(lit.)
Dichte
1.007 g/mL · 1.007 g/mL at 25 °C(lit.)
Dampfdruck
0.05 mm · 0.05 mm Hg ( 25 °C)
Brechungsindex
20 · n20/D 1.499(lit.)
Flammpunkt
230 °F · >230 °F

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Danger

H302+H312 (25.5%): Harmful if swallowed or in contact with skin [Warning Acute toxicity, oral; acute toxicity, dermal];H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral];H312 (100%): Harmful in contact with skin [Warning Acute toxicity, dermal];H314 (98.7%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation];H318 (71.2%): Causes serious eye damage [Danger Serious eye damage/eye irritation]

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

Aggregated GHS information provided per 153 reports by companies from 6 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 · 3 Einträge

2-Pyrrolidinone, 1-cyclohexyl- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 2-Pyrrolidinone, 1-cyclohexyl- 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: 09-01-2018 https://echa.europa.eu/registration-dossier/-/registered-dossier/21831

2-Pyrrolidinone, 1-cyclohexyl-: Does not have an individual approval but may be used under an appropriate group standard

Hazards Summary · 1 Eintrag

No adverse fetal effects observed in rats or rabbits by oral administration during organogenesis; [Shepard's Catalog of Teratogenic Agents] A severe skin and eye irritant; Causes other changes of the liver, kidney, ureter, and bladder in oral lethal-dose studies of rats; [RTECS] An irritant that may cause serious eye injury; Highly toxic by inhalation; Harmful by ingestion and skin absorption; [Alfa Aesar MSDS] See N-Ethyl-2-pyrrolidone and N-Methyl-2-pyrrolidone.

Hazard Classes and CategoriesAcute Tox. 4 (100%);Acute Tox. 4 (100%);Skin Corr. 1B (98.7%);Eye Dam. 1 (71.2%)

Toxikologische Informationen

Toxicity DataLC50 (rat) = 120 ppm/1hr

Regulatorische Informationen

Regulatory Information · 3 Einträge

2-Pyrrolidinone, 1-cyclohexyl- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 2-Pyrrolidinone, 1-cyclohexyl- 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: 09-01-2018 https://echa.europa.eu/registration-dossier/-/registered-dossier/21831

2-Pyrrolidinone, 1-cyclohexyl-: Does not have an individual approval but may be used under an appropriate group standard

Sicherheitsdaten

wgk
1
tsca
TSCA listed
ridadr
UN 2810 6.1/PG 2
hs_code
29337900
RTECS-Nr.
UY5748450
risk_code
22-36/37/38-26-21/22-34

Chemie und Industrie

Verwendung und Herstellung

U.S. Production2023: <50,000 lb;2022: <50,000 lb;2021: 50,000 - <250,000 lb;2020: 50,000 - <250,000 lb
Industry UsesSolvent
General Manufacturing Information · 2 Einträge

Synthetic Dye and Pigment Manufacturing

2-Pyrrolidinone, 1-cyclohexyl-: ACTIVE

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]
湖北永阔科技有限公司027-59223108 15972152991 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
Shandong chuangyingchemical Co., Ltd.18853181302 · [email protected]

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