Bromoacetate

HCID 6226CAS 68-10-0

Grundinformationen

Standard-SMILES
O=C([O-])CBr
InChIKey
KDPAWGWELVVRCH-UHFFFAOYSA-M
Summenformel
C2H2BrO2-
Durchschnittliche Molmasse
137,94 g/mol
Monoisotopische Masse
136,92436498

Überblick

Bromoacetate is an organohalogen compound and a carboxylic acid.

Namen und Bezeichner

Bevorzugter Name
Bromoacetate
IUPAC
2-bromoacetate
Englischer Name
bromoacetate
Molmasse
0

Namen und Synonyme

Bromoacetate68-10-0monobromoacetateDTXSID60218189RefChem:121532DTXCID301406802-bromoacetateACETIC ACID, BROMO-, ION(1-)Bromoacetate(1-)alpha-bromoacetateCHEBI:192408KDPAWGWELVVRCH-UHFFFAOYSA-M

Datenbank-Bezeichner

CAS
68-10-0
PubChem CID
6226
DTXSID
DTXSID60218189
ChEBI
CHEBI:192408
Nikkaji
J1.313.419G

Eigenschaften

Berechnete Struktureigenschaften

XLogP
1,2
Polarare Oberfläche (TPSA)
40,1 Ų
H-Brücken-Donoren
0
H-Brücken-Akzeptoren
2
Frei drehbare Bindungen
0
Schwere Atome
5

Sicherheit und Regulatorisches

Toxikologische Informationen

Treatment · 1 Eintrag

EYES: irrigate opened eyes for several minutes under running water. INGESTION: do not induce vomiting. Rinse mouth with water (never give anything by mouth to an unconscious person). Seek immediate medical advice. SKIN: should be treated immediately by rinsing the affected parts in cold running water for at least 15 minutes, followed by thorough washing with soap and water. If necessary, the person should shower and change contaminated clothing and shoes, and then must seek medical attention. INHALATION: supply fresh air. If required provide artificial respiration.

Health Effects · 1 Eintrag

Bromoacetic acid is a strong lachrymator. Animal studies have also indicated that bromoacetic acid is a teratogen (a developmental toxin) leading to soft tissue malformations in fetuses at doses of 100 mg/kg/day. Bromoacetic acid is also a mutagen and a cytotoxic agent.

Exposure RoutesOral (L626) ; inhalation (L626) ; dermal (L626)
Toxicity Summary · 1 Eintrag

Organobromide compounds, especially alkylbromides are strong alkylating agents. Consequently they can randomly modify the surfaces of proteins and lipids, leading to the disruption of enzyme, transporter or membrane functions. One of the most probable protein targets is the TRPA1 ion channel that is expressed in sensory nerves (trigeminal nerve) of the eyes, nose, mouth and lungs. Alkylation of DNA by organobromides may also lead to mutations.

Signs and Symptoms · 1 Eintrag

Contact can lead to severe skin and eye burns, it can also irritate the nose throat and lungs if inhaled. Inhalation may result in spasm, inflammation and edema of the larynx and bronchi, chemical pneumonitis, and pulmonary edema. Symptoms of exposure may include burning sensation, coughing, wheezing, laryngitis, shortness of breath, headache, nausea, and vomiting. Material is extremely destructive to tissue of the mucous membranes and upper respiratory tract, eyes, and skin.

Carcinogen ClassificationNo indication of carcinogenicity to humans (not listed by IARC).

Chemie und Industrie

Verwendung und Herstellung

UsesBromoacetici acid is an industrial and laboratory chemical. It is produced as a drinking water disinfection by-product and small amounts may be found in treated drinking water.

Anbieter1 Anbieter

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