4-Nitro-m-xylol

4-Nitro-m-xylene

HCID 6991CAS 89-87-2

Grundinformationen

Standard-SMILES
Cc1ccc([N+](=O)[O-])c(C)c1
InChIKey
BBUPBICWUURTNP-UHFFFAOYSA-N
Summenformel
C8H9NO2
Durchschnittliche Molmasse
151,16 g/mol
Monoisotopische Masse
151,06332853

Überblick

1,3-dimethyl-4-nitrobenzene is a light yellow to amber liquid. (NTP, 1992)

Namen und Bezeichner

Bevorzugter Name
4-Nitro-m-xylene
IUPAC
2,4-dimethyl-1-nitrobenzene
Lokaler Name
4-Nitro-m-xylol
Englischer Name
4-Nitro-1,3-dimethylbenzene
Summenformel
C8H9NO2
Molmasse
151.16

Namen und Synonyme

4-NITRO-M-XYLENE2,4-Dimethyl-1-nitrobenzene1,3-Dimethyl-4-nitrobenzeneBenzene, 2,4-dimethyl-1-nitro-2,4-DimethylnitrobenzeneNSC 50661CCRIS 3120DTXSID2025135EINECS 201-947-4UNII-7EM84EUE057EM84EUE05NSC-50661
Weitere Namen anzeigen
Nitromxylenem-Nitroxylene4-Nitro-m-xylol2,4-Nitroxylenem-xylene,4-nitro-4-Nitro-1,3-xylol4-Nitro-1,3-xylene
DTXCID605135EC 201-947-4DIMETHYL-4-NITROBENZENE, 1,3-RefChem:100030201-947-4BBUPBICWUURTNP-UHFFFAOYSA-N89-87-24-Nitro-1,3-dimethylbenzene

Datenbank-Bezeichner

CAS
89-87-2
PubChem CID
6991
DTXSID
DTXSID2025135
ChEMBL
CHEMBL3182934
UNII
7EM84EUE05
EC Number
201-947-4
Nikkaji
J44.130I

Eigenschaften

Berechnete Struktureigenschaften

XLogP
2,7
Polarare Oberfläche (TPSA)
45,8 Ų
H-Brücken-Donoren
0
H-Brücken-Akzeptoren
2
Frei drehbare Bindungen
0
Schwere Atome
11

Experimentelle und physikochemische Eigenschaften

SpringerMaterials PropertiesBoiling point
Density1.135 at 59 °F (NTP, 1992) - Denser than water; will sink
Solubilityless than 1 mg/mL at 70 °F (NTP, 1992)
Flash Point225 °F (NTP, 1992)
Boiling Point459 to 462 °F at 760 mmHg (NTP, 1992)
Melting Point36 °F (NTP, 1992)

Physikochemische Eigenschaften

Schmelzpunkt
7 · 7-9 °C(lit.)
Siedepunkt
244 °C · 244 °C(lit.)
Dichte
1.117 g/mL · 1.117 g/mL at 25 °C(lit.)
Brechungsindex
20 · n20/D 1.549(lit.)
Flammpunkt
225 °F · 225 °F
storage temp.
30 °C · Store below +30°C.

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 4 Einträge

Warning

H302 (98.7%): Harmful if swallowed [Warning Acute toxicity, oral]

P264, P270, P301+P317, P330, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 149 reports by companies from 4 notifications to the ECHA C&L Inventory.

Gefahrenhinweise

Regulatory InformationStatus: Cease Manufacture Update: 14-12-2015 https://echa.europa.eu/registration-dossier/-/registered-dossier/12516
DOT LabelPoison
Fire HazardsThis chemical is combustible. (NTP, 1992)
Health HazardsSYMPTOMS: Symptoms of exposure to this compound may include irritation of the skin, eye, mucous membrane and upper respiratory tract and cyanosis. Similar chemicals cause methemoglobinemia.
Reactive GroupNitro, Nitroso, Nitrate, and Nitrite Compounds, Organic
Reactivity Profile1,3-DIMETHYL-4-NITROBENZENE is incompatible with strong oxidizing agents and strong bases (NTP, 1992).

Sicherheit und Schutzausrüstung

Fire FightingFires involving this material can be controlled with a dry chemical, carbon dioxide, or Halon extinguisher. A water spray may also be used. (NTP, 1992)
First Aid · 1 Eintrag

EYES: First check the victim for contact lenses and remove if present. Flush victim's eyes with water or normal saline solution for 20 to 30 minutes while simultaneously calling a hospital or poison control center. Do not put any ointments, oils, or medication in the victim's eyes without specific instructions from a physician. IMMEDIATELY transport the victim after flushing eyes to a hospital even if no symptoms (such as redness or irritation) develop.

Nonfire Spill Response · 1 Eintrag

SMALL SPILLS AND LEAKAGE: Should a spill occur while you are handling this chemical, FIRST REMOVE ALL SOURCES OF IGNITION, then you should dampen the solid spill material with 60-70% ethanol and transfer the dampened material to a suitable container. Use absorbent paper dampened with 60-70% ethanol to pick up any remaining material. Seal the absorbent paper, and any of your clothes, which may be contaminated, in a vapor-tight plastic bag for eventual disposal. Solvent wash all contaminated surfaces with 60-70% ethanol followed by washing with a soap and water solution. Do not reenter the contaminated area until the Safety Officer (or other responsible person) has verified that the area has been properly cleaned.

Isolation and EvacuationExcerpt from ERG Guide 152 [Substances - Toxic (Combustible)]:
Personal Protective Equipment (PPE) · 1 Eintrag

RECOMMENDED RESPIRATOR: Where the neat test chemical is weighed and diluted, wear a NIOSH-approved half face respirator equipped with an organic vapor/acid gas cartridge (specific for organic vapors, HCl, acid gas and SO2) with a dust/mist filter. (NTP, 1992)

Sicherheitsdaten

wgk
2
tsca
TSCA listed
ridadr
UN 1665 6.1/PG 2
hs_code
29042000
risk_code
22-20/21/22-36/37/38-23/24/25
hazard_code
Xn,T

Chemie und Industrie

Verwendung und Herstellung

General Manufacturing InformationBenzene, 2,4-dimethyl-1-nitro-: ACTIVE

Anbieter16 Anbieter

陕西缔都医药有限责任公司029-81124775 17791530730 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
北京京土恒盛化工科技有限公司00-13911456598 13911456598 · [email protected]
湖北中隆康盛精细化工有限公司027-027-83850368 18140587623 · [email protected]
上海阿拉丁生化科技股份有限公司6206333 13167063860 · [email protected]

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