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1120-10-1

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Basic Information
CAS No.: 1120-10-1
Name: 9-Chlorononanoic acid
Article Data: 1
Molecular Structure:
Molecular Structure of 1120-10-1 (9-Chlorononanoic acid)
Formula: C9H17 Cl O2
Molecular Weight: 192.686
Synonyms: 9-Chlorononanoicacid; w-Chlorononanoic acid
Density: 1.052g/cm3
Melting Point: 29-30 °C
Boiling Point: 301.1°Cat760mmHg
Flash Point: 135.9°C
Safety: Moderately toxic by ingestion and inhalation. When heated to decomposition it emits toxic fumes of Cl−.
PSA: 37.30000
LogP: 3.04050
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Chemistry

Product Name: 9-Chlorononanoic acid (CAS NO.1120-10-1)


Molecular Formula: C9H17ClO2
Molecular Weight: 192.71g/mol
Mol File: 1120-10-1.mol
Boiling point: 301.1 °C at 760 mmHg
Flash Point: 135.9 °C
Density: 1.052 g/cm3
Surface Tension:  36.6 dyne/cm 
Enthalpy of Vaporization: 59.53 kJ/mol
Vapour Pressure: 0.000253 mmHg at 25°C
XLogP3-AA: 1.7
H-Bond Donor: 1
H-Bond Acceptor: 2
Structure Descriptors of 9-Chlorononanoic acid (CAS NO.1120-10-1):
  IUPAC Name: 9-chlorononanoic acid
  Canonical SMILES: C(CCCCCl)CCCC(=O)O
  InChI: InChI=1S/C9H17ClO2/c10-8-6-4-2-1-3-5-7-9(11)12/h1-8H2,(H,11,12) 
  InChIKey: DFJLDESPZKERQH-UHFFFAOYSA-N

Toxicity Data With Reference

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LCLo inhalation 500mg/m3/2H (500mg/m3) BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)

LUNGS, THORAX, OR RESPIRATION: RESPIRATORY DEPRESSION

LIVER: FATTY LIVER DEGERATION		 Toksikologiya Novykh Promyshlennykh Khimicheskikh Veshchestv. Toxicology of New Industrial Chemical Substances. For English translation, see TNICS*. Vol. 5, Pg. 89, 1963.
mouse LD50 oral 2gm/kg (2000mg/kg) BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)

LUNGS, THORAX, OR RESPIRATION: RESPIRATORY DEPRESSION

GASTROINTESTINAL: OTHER CHANGES		 Toksikologiya Novykh Promyshlennykh Khimicheskikh Veshchestv. Toxicology of New Industrial Chemical Substances. For English translation, see TNICS*. Vol. 5, Pg. 89, 1963.
rat LC inhalation > 500mg/m3/2H (500mg/m3) BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)

LUNGS, THORAX, OR RESPIRATION: RESPIRATORY DEPRESSION

LIVER: FATTY LIVER DEGERATION		 Toksikologiya Novykh Promyshlennykh Khimicheskikh Veshchestv. Toxicology of New Industrial Chemical Substances. For English translation, see TNICS*. Vol. 5, Pg. 89, 1963.
rat LD50 oral 3gm/kg (3000mg/kg) BEHAVIORAL: EXCITEMENT

BEHAVIORAL: MUSCLE WEAKNESS

BEHAVIORAL: TETANY		 Gigiena i Sanitariya. For English translation, see HYSAAV. Vol. 27(10), Pg. 12, 1962.

Safety Profile

Moderately toxic by ingestion and inhalation. When heated to decomposition it emits toxic fumes of Cl−.

Specification

 9-Chlorononanoic acid , its CAS NO. is 1120-10-1, the synonyms are 4-02-00-01025 (Beilstein Handbook Reference) ; BRN 1759809 ; Chloropelargonic acid ; Chlorperalgonic ; Nonanoic acid, 9-chloro- .