1-Nitrobutane
Grundinformationen
- CAS
52006-62-9- Standard-SMILES
CCCC[N+](=O)[O-]- InChIKey
NALZTFARIYUCBY-UHFFFAOYSA-N- Summenformel
- C4H9NO2
- Durchschnittliche Molmasse
- 103,12 g/mol
- Monoisotopische Masse
- 103,06332853
Überblick
1-nitrobutane is a colorless liquid. (NTP, 1992)
Namen und Bezeichner
- Bevorzugter Name
- 1-Nitrobutane
- IUPAC
- 1-nitrobutane
- Englischer Name
- 1-Nitrobutane
- Summenformel
- C4H9NO2
- Molmasse
- 103.12
Namen und Synonyme
1-NITROBUTANE627-05-4Butane, 1-nitro-CCRIS 30891-nitro-butaneNSC 3648EINECS 210-980-3BRN 1743017DTXSID8020967UNII-7R02589S2GAI3-001077R02589S2G
Weitere Namen anzeigen
4-01-00-00277 (Beilstein Handbook Reference)NSC-3648MFCD0000740952006-62-9nitrobutaneNSC36481-Nitrobutane, 98%NITROBUTANE, 1-
Datenbank-Bezeichner
- CAS
52006-62-9、627-05-4- PubChem CID
- 12302
- DTXSID
DTXSID8020967- ChEMBL
CHEMBL1448549- ChEBI
CHEBI:138425- UNII
- 7R02589S2G
- EC Number
- 210-980-3
- Nikkaji
- J1.695K
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 1,5
- Polarare Oberfläche (TPSA)
- 45,8 Ų
- H-Brücken-Donoren
- 0
- H-Brücken-Akzeptoren
- 2
- Frei drehbare Bindungen
- 2
- Schwere Atome
- 7
- Formalladung
- 0
- Komplexität
- 57,2
Experimentelle und physikochemische Eigenschaften
Chemical ClassesNitrogen Compounds -> Nitros, Aliphatic
SpringerMaterials PropertiesBoiling point
LogP1.38
Density0.971 (NTP, 1992) - Less dense than water; will float
SolubilitySlightly soluble (NTP, 1992)
Boiling Point307 °F at 760 mmHg (NTP, 1992)
Vapor Pressure3.79 [mmHg]
Physical Description
1-nitrobutane is a colorless liquid. (NTP, 1992)
Colorless liquid; [CAMEO]
Physikochemische Eigenschaften
- Spezifische Wärmekapazität
- 1.12 J/ · Cp(gas): 1.12 J/(g·K), at 25℃
Sicherheit und Regulatorisches
Sicherheitsangaben dienen nur zur Orientierung und ersetzen weder das Sicherheitsdatenblatt (SDB) des Lieferanten noch geltende Vorschriften oder eine fachliche Bewertung.
GHS-Klassifizierung
GHS Classification
Warning
H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]
P210, P233, P240, P241, P242, P243, P280, P303+P361+P353, P370+P378, P403+P235, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 1 notifications to the ECHA C&L Inventory.
Gefahrenhinweise
DOT LabelFlammable Liquid
Fire HazardsExcerpt from ERG Guide 128 [Flammable Liquids (Water-Immiscible)]:
Health HazardsExcerpt from ERG Guide 128 [Flammable Liquids (Water-Immiscible)]:
Hazards SummaryHighly flammable; [CAMEO] May cause irritation; [MSDSonline] See Nitroethane.
Reactive GroupNitro, Nitroso, Nitrate, and Nitrite Compounds, Organic
Reactivity AlertsHighly Flammable
Reactivity Profile
Nitroalkanes, such as 1-NITROBUTANE, range from slight to strong oxidizing agents. If mixed with reducing agents, including hydrides, sulfides and nitrides, they may begin a vigorous reaction that culminates in a detonation. Nitroalkanes are milder oxidizing agents, but still react violently with reducing agents at higher temperature and pressures. Nitroalkanes react with inorganic bases to form explosive salts. The presence of metal oxides increases the thermal sensitivity of nitroalkanes. Nitroalkanes with more than one nitro group are generally explosive. Nitroalkanes are insoluble in water. Flammable/combustible material. May be ignited by heat, sparks or flames.
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