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5830-30-8

Basic Information
CAS No.: 5830-30-8
Name: N,N-DIMETHYLHEXANAMIDE
Article Data: 21
Molecular Structure:
Molecular Structure of 5830-30-8 (N,N-DIMETHYLHEXANAMIDE)
Formula: C8H17 N O
Molecular Weight: 143.229
Synonyms: Caproamide,N,N-dimethyl- (4CI); N,N-Dimethylcaproamide; N,N-Dimethylhexanamide
Density: 0.868g/cm3
Boiling Point: 207.3°Cat760mmHg
Flash Point: 78.2°C
Hazard Symbols: R22:Harmful if swallowed.;
Risk Codes: R22;
Safety: Poison by intravenous route. Moderately toxic by ingestion and intraperitoneal routes. When heated to decomposition it emits toxic fumes of NOx.
PSA: 20.31000
LogP: 1.65490
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Chemistry

Product Name: N,N-Dimethylcaproamide (CAS NO.5830-30-8)


Molecular Formula: C8H17NO
Molecular Weight: 143.23g/mol
Mol File: 5830-30-8.mol
Einecs: 227-406-2
Boiling point: 207.3 °C at 760 mmHg
Flash Point: 78.2 °C
Density: 0.868 g/cm3
Refractive index: 1.4490
Surface Tension: 28.5 dyne/cm
Enthalpy of Vaporization: 44.35 kJ/mol
Vapour Pressure: 0.227 mmHg at 25°C
XLogP3-AA: 1.6
H-Bond Donor: 0
H-Bond Acceptor: 1
Structure Descriptors of N,N-Dimethylcaproamide (CAS NO.5830-30-8):
  IUPAC Name: N,N-dimethylhexanamide
  Canonical SMILES: CCCCCC(=O)N(C)C
  InChI: InChI=1S/C8H17NO/c1-4-5-6-7-8(10)9(2)3/h4-7H2,1-3H3 
  InChIKey: OAERLTPBKQBWHJ-UHFFFAOYSA-N

Toxicity Data With Reference

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 425mg/kg (425mg/kg) BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)

BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD
American Industrial Hygiene Association Journal. Vol. 32, Pg. 539, 1971.
mouse LD50 intravenous 90mg/kg (90mg/kg) BEHAVIORAL: CHANGES IN MOTOR ACTIVITY (SPECIFIC ASSAY)

LUNGS, THORAX, OR RESPIRATION: DYSPNEA

BLOOD: HEMORRHAGE
American Industrial Hygiene Association Journal. Vol. 32, Pg. 539, 1971.
rabbit LD50 intraperitoneal 520mg/kg (520mg/kg) BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)

BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD
American Industrial Hygiene Association Journal. Vol. 32, Pg. 539, 1971.
rabbit LD50 intravenous 64mg/kg (64mg/kg) BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)

BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD
American Industrial Hygiene Association Journal. Vol. 32, Pg. 539, 1971.
rabbit LD50 oral 1100mg/kg (1100mg/kg) BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)

BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD
American Industrial Hygiene Association Journal. Vol. 32, Pg. 539, 1971.

Consensus Reports

Reported in EPA TSCA Inventory.

Safety Profile

Poison by intravenous route. Moderately toxic by ingestion and intraperitoneal routes. When heated to decomposition it emits toxic fumes of NOx.

Specification

 N,N-Dimethylcaproamide ,its CAS NO. is 5830-30-8,the synonyms is  3-04-00-00127 (Beilstein Handbook Reference) ; AI3-36607 ; BRN 1747074 ; EINECS 227-406-2 ; Hexanamide, N,N-dimethyl- .