IUPAC Name: 1-Chloropropane-1,3-diol
Following is the structure of Chloropropane diol-1,3 (CAS NO.1331-07-3):
Empirical Formula: C3H7ClO2
Molecular Weight: 110.5395 g/mol
Surface Tension: 45.8 dyne/cm
Index of Refraction: 1.473
Density: 1.303 g/cm3
Flash Point: 114.9 °C
Enthalpy of Vaporization: 58.56 kJ/mol
Boiling Point: 266.3 °C at 760 mmHg
Vapour Pressure of Chloropropane diol-1,3 (CAS NO.1331-07-3): 0.00119 mmHg at 25 °C
Canonical SMILES: C(CO)C(O)Cl
InChI: InChI=1S/C3H7ClO2/c4-3(6)1-2-5/h3,5-6H,1-2H2
InChIKey: PSYQXTDKRKLJQC-UHFFFAOYSA-N
1. | skn-rbt 10 mg/24H | JIHTAB Journal of Industrial Hygiene and Toxicology. 30 (1948),63. | ||
2. | eye-rbt 20 mg | JIHTAB Journal of Industrial Hygiene and Toxicology. 30 (1948),63. | ||
3. | orl-rat LD50:110 mg/kg | JIHTAB Journal of Industrial Hygiene and Toxicology. 30 (1948),63. | ||
4. | ihl-rat LCLo:1000 ppm/1H | JIHTAB Journal of Industrial Hygiene and Toxicology. 30 (1948),63. | ||
5. | skn-rbt LD50:450 mg/kg | JIHTAB Journal of Industrial Hygiene and Toxicology. 30 (1948),63. |
Poison by ingestion. Moderately is toxic by skin contact. Mildly is toxic by inhalation. A skin and eye irritant. Reaction with 70% perchloric acid forms a dangerously unstable explosive product. When heated to decomposition, Chloropropane diol-1,3 (CAS NO.1331-07-3) emits toxic fumes of Cl−.
Chloropropane diol-1,3 , its cas register number is 1331-07-3. It also can be called 1,3-Propanediol, chloro- .
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