Octylamine (HCID 8143)

Überblick

Octanamine appears as a yellow liquid with an ammonia-like odor. Insoluble in water and less dense than water. Hence floats on water. Contact may irritate skin, eyes and mucous membranes. May be toxic by ingestion. Used to make other chemicals.

Namen und Bezeichner

Bevorzugter Name: Octylamine
IUPAC: octan-1-amine
Lokaler Name: Octylamin
Englischer Name: Octylamine
Summenformel: C8H19N
Molmasse: 129.24

Namen und Synonyme

Octylamineoctan-1-amineN-OCTYLAMINE111-86-41-Aminooctane1-Octanamine1-OctylamineCaprylamineCaprylylamineOctanamineArmeen 8Armeen 8D

Weitere Namen anzeigen

AMINE C8Octylaminocylaminearmeen8

MonoctylamineDTXSID8021939SF0V8U4T67GENAMIN 8RNSC-9824CHEBI:7728DTXCID401939RefChem:167904

Datenbank-Bezeichner

CAS: 111-86-4、68037-94-5
PubChem CID: 8143
DTXSID: DTXSID8021939
ChEMBL: CHEMBL1160509
ChEBI: CHEBI:7728
UNII: SF0V8U4T67
EC Number: 203-916-0
Nikkaji: J5.115B

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 3,1
Polarare Oberfläche (TPSA): 26 Å²
H-Brücken-Donoren: 1
H-Brücken-Akzeptoren: 1
Frei drehbare Bindungen: 6
Schwere Atome: 9
Formalladung: 0
Komplexität: 43,8

Experimentelle und physikochemische Eigenschaften

Chemical ClassesNitrogen Compounds -> Amines, Aliphatic

SpringerMaterials PropertiesBoiling point

Density0.779 @ 20°C

Vapor Pressure0.96 [mmHg]

Food Contact SubstancesFCS -> FDA Cumulative Estimated Daily Intake (CEDI)

Physical Description · 3 Einträge

Octanamine appears as a yellow liquid with an ammonia-like odor. Insoluble in water and less dense than water. Hence floats on water. Contact may irritate skin, eyes and mucous membranes. May be toxic by ingestion. Used to make other chemicals.

Liquid

Yellow liquid with an ammoniacal odor; [CAMEO] Clear colorless liquid; [Sigma-Aldrich MSDS]

Physikochemische Eigenschaften

Schmelzpunkt: 5 · −5-−1 °C(lit.)
Siedepunkt: 175 · 175-177 °C(lit.)
Dichte: 0.782 g/mL · 0.782 g/mL at 25 °C(lit.)
Dampfdruck: 1 mm · 1 mm Hg ( 20 °C)
Brechungsindex: 20 · n20/D 1.429(lit.)
Flammpunkt: 145 °F · 145 °F
storage temp.: 30 °C · Store below +30°C.
Löslichkeit: 0.32 g/l · 0.32g/l
Aggregatzustand: Liquid
pka: 10.65 · 10.65(at 25℃)
Farbe: Clear
PH: 11.8 · 11.8 (100g/l, H2O, 25℃)
Geruch (Odor): strong fishy ammonia-like odor
Explosionsgrenze: 1.6 · 1.6-8.2%(V)
Wasserlöslichkeit: 0.2 g/L · 0.2 g/L (25 ºC)
BRN: 1679227 · 1679227
Henry's Law Constant: 2.2 · 2.2×10-1 mol/(m3Pa) at 25℃, Brockbank (2013)
Dielectric constant: 3.58 · 3.5800000000000001
InChI: 1S/C8H19N/c1-2-3-4-5-6-7-8-9/h2-9H2,1H3
InChIKey: IOQPZZOEVPZRBK-UHFFFAOYSA-N
SMILES: CCCCCCCCN
LogP: 3.46 at · 3.46 at 20℃
CAS Datenbank: 111 · 111-86-4(CAS DataBase Reference)
NIST chemische Informationen: 1 · 1-Octanamine(111-86-4)
EPA chemische Informationen: Octylamine (111-86-4)

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 6 Einträge

Danger

H226 (95.9%): Flammable liquid and vapor [Warning Flammable liquids]

P210, P233, P240, P241, P242, P243, P260, P261, P262, P264, P264+P265, P270, P271, P273, P280, P301+P316, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P317, P319, P321, P330, P361+P364, P362+P364, P363, P370+P378, P391, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 790 reports by companies from 22 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Danger

H226: Flammable liquid and vapor [Warning Flammable liquids]

Gefahrenhinweise

Regulatory Information · 4 Einträge

Chemical: 1-Octanamine

1-Octanamine is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 1-Octanamine 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: 28-01-2021 https://echa.europa.eu/registration-dossier/-/registered-dossier/1996

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

DOT LabelCorrosive

Fire HazardsExcerpt from ERG Guide 153 [Substances - Toxic and/or Corrosive (Combustible)]:

Health HazardsExcerpt from ERG Guide 153 [Substances - Toxic and/or Corrosive (Combustible)]:

Hazards Summary · 1 Eintrag

A severe eye irritant; Causes somnolence in dermal lethal-dose studies of rabbits; [RTECS] Causes burns; Inhalation may cause corrosive injuries to upper respiratory tract; Harmful by ingestion, inhalation, and skin absorption; [Sigma-Aldrich MSDS]

Reactive GroupAmines, Phosphines, and Pyridines

Sicherheit und Schutzausrüstung

Fire FightingExcerpt from ERG Guide 153 [Substances - Toxic and/or Corrosive (Combustible)]:

First AidExcerpt from ERG Guide 153 [Substances - Toxic and/or Corrosive (Combustible)]:

Nonfire Spill ResponseExcerpt from ERG Guide 153 [Substances - Toxic and/or Corrosive (Combustible)]:

Isolation and EvacuationExcerpt from ERG Guide 153 [Substances - Toxic and/or Corrosive (Combustible)]:

Protective Action Criteria (PAC) · 3 Einträge

1.1 [mg/m3]

12 [mg/m3]

71 [mg/m3]

Personal Protective Equipment (PPE)Excerpt from ERG Guide 153 [Substances - Toxic and/or Corrosive (Combustible)]:

Toxikologische Informationen

Adverse EffectsDermatotoxin - Skin burns.

Sicherheitsdaten

wgk: 2
tsca: TSCA listed
ridadr: UN 2735 8/PG 2
hs_code: 29211980
RTECS-Nr.: RG8050000
risk_code: 34-50-35-20/21/22
Toxizität: LD50 orally in Rabbit: > 250 mg/kg LD50 dermal Rabbit 200 - 2000 mg/kg
hazard_code: C,N
safety_code: 26-36/37/39-45-61-29
hazard_class: 8
packing_group: II
Speicherklasse: 3 - Flammable liquids
Hazard Classifications: Acute Tox. 3 DermalAcute Tox. 3 OralAcute Tox. 4 InhalationAquatic Acute 1Aquatic Chronic 2Eye Dam. 1Flam. Liq. 3Skin Corr. 1ASTOT SE 3
Selbstentzündungstemperatur: 265 °C

Chemie und Industrie

Verwendung und Herstellung

UsesUsed to make other chemicals; [CAMEO] Used to make large scale and fine chemicals, in functional fluids, and as a laboratory reagent; [ExPub: ECHA REACH Registrations]

U.S. Production2023: 1,000,000 - <2,500,000 lb

Consumer UsesLubricating agent

Industry UsesIntermediate

General Manufacturing Information · 2 Einträge

Computer and Electronic Product Manufacturing

1-Octanamine: ACTIVE

Anwendungen · 1 Eintrag

Verwenden1-Octylamine is used as a precursor to prepare chemicals. It finds application in functional fluids and as a laboratory reagent. Further, it is used as a reactant in the preparation of 2H-indazoles and 1H-indazolones, which are used as myeloperoxidase(MPO) inhibitors.