Butanal,2,2,3-trichloro

Modify Date: 2025-08-25 16:00:04

Butanal,2,2,3-trichloro Structure
Butanal,2,2,3-trichloro structure
Common Name Butanal,2,2,3-trichloro
CAS Number 76-36-8 Molecular Weight 175.44100
Density 1.387g/cm3 Boiling Point 165ºC at 760 mmHg
Molecular Formula C4H5Cl3O Melting Point N/A
MSDS N/A Flash Point 64.6ºC

 Names

Name 2,2,3-trichlorobutanal
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.387g/cm3
Boiling Point 165ºC at 760 mmHg
Molecular Formula C4H5Cl3O
Molecular Weight 175.44100
Flash Point 64.6ºC
Exact Mass 173.94100
PSA 17.07000
LogP 1.98650
Index of Refraction 1.469
InChIKey OXVISHZELPRKFQ-UHFFFAOYSA-N
SMILES CC(Cl)C(Cl)(Cl)C=O

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
ES3850000
CHEMICAL NAME :
Butyraldehyde, 2,2,3-trichloro-
CAS REGISTRY NUMBER :
76-36-8
BEILSTEIN REFERENCE NO. :
1749046
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C4-H5-Cl3-O
MOLECULAR WEIGHT :
175.44
WISWESSER LINE NOTATION :
VHXGGYG1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
125 mg/kg
TOXIC EFFECTS :
Behavioral - changes in motor activity (specific assay)
REFERENCE :
CBCCT* "Summary Tables of Biological Tests," National Research Council Chemical-Biological Coordination Center. (National Academy of Science Library, 2101 Constitution Ave., NW, Washington, DC 20418) Volume(issue)/page/year: 6,218,1954

 Synthetic Route

 Synonyms

Butyrchloral
2,2,3-trichloro-1-oxobutane
Butyraldehyde,2,2,3-trichloro
Anhydrous butylchloral
2,2,3-trichloro-butyraldehyde
Butylchloral
Butanal,2,2,3-trichloro
2,2,3-Trichlor-butyraldehyd
Crotonchloral
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