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91-49-6

Basic Information
CAS No.: 91-49-6
Name: N-Butylacetanilide
Article Data: 9
Molecular Structure:
Molecular Structure of 91-49-6 (N-Butylacetanilide)
Formula: C12H17 N O
Molecular Weight: 191.273
Synonyms: Acetanilide,N-butyl- (6CI,7CI,8CI); BAA; Butylacetanilide; N-Butylacetanilide;N-n-Butylacetanilide; NSC 7662
EINECS: 202-071-5
Density: 0.9303 g/cm3 (16 C)
Melting Point: 21 C
Boiling Point: 273 - 275 C
Flash Point: 141 C
Solubility: clear to yellow liquid
Hazard Symbols: UN NO.
Safety: Poison by ingestion. Combustible. To fight fire, use CO2, dry chemical. When heated to decomposition it emits toxic fumes of NOx.
Transport Information: OTH
PSA: 20.31000
LogP: 2.83960
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Chemistry

Molecular Formula: C12H17NO
Molar mass: 191.27 g/mol
EINECS: 202-071-5
Density: 1.003 g/cm3
Flash Point: 116.9 °C
Index of Refraction: 1.532
Boiling Point: 281 °C at 760 mmHg
Vapour Pressure: 0.00366 mmHg at 25°C
Structure of 4-(2-Aminoethyl)morpholine (2038-03-1):
              
XLogP3-AA: 2.5
H-Bond Donor: 0
H-Bond Acceptor: 1
IUPAC Name: N-butyl-N-phenylacetamide
Canonical SMILES: CCCCN(C1=CC=CC=C1)C(=O)C
InChI: InChI=1S/C12H17NO/c1-3-4-10-13(11(2)14)12-8-6-5-7-9-12/h5-9H,3-4,10H2,
1-2H3 
InChIKey: ZWDZJRRQSXLOQR-UHFFFAOYSA-N

Uses

 N-Butylacetanilide (91-49-6) can be used for pesticides.

Toxicity Data With Reference

1.    

orl-mus LD50:800 mg/kg

    TXAPA9    Toxicology and Applied Pharmacology. 19 (1971),20.
2.    

orl-gpg LD50:300 mg/kg

    28ZEAL    Pesticide Index. 4 (1969),78.

Consensus Reports

Reported in EPA TSCA Inventory.

Safety Profile

Poison by ingestion. Combustible. To fight fire, use CO2, dry chemical. When heated to decomposition it emits toxic fumes of NOx.

Specification

 N-Butylacetanilide (91-49-6) also can be called Acetyl-N-butylaniline ; Acetamide, N-butyl-N-phenyl- ; N-Butyl-N-phenylacetamide .