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CAS No.: | 16224-33-2 |
---|---|
Name: | 1-Butoxy-3-chloro-2-propanol |
Article Data: | 20 |
Molecular Structure: | |
Formula: | C7H15 Cl O2 |
Molecular Weight: | 166.648 |
Synonyms: | 1-Butoxy-2-hydroxy-3-chloropropane;Butyl 3-chloro-2-hydroxypropyl ether; NSC 86961 |
Density: | 1.043g/cm3 |
Boiling Point: | 238.6°C at 760 mmHg |
Flash Point: | 98.1°C |
Safety: | Moderately toxic by ingestion. A skin and severe eye irritant. See also ETHERS. When heated to decomposition it emits toxic fumes of Cl−. |
PSA: | 29.46000 |
LogP: | 1.40280 |
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IUPAC Name: 1-Butoxy-3-chloropropan-2-ol
Synonyms of Butyl 3-chloro-2-hydroxypropyl ether (CAS NO.16224-33-2 ): 1-Butoxy-3-chloro-2-propanol ; Butyl-chlorhydrinether ; Ether, butyl (3-chloro-2-hydroxypropyl) ; 2-Propanol, 1-butoxy-3-chloro- ; Ether, butyl (3-chloro-2-hydroxypropyl)
InChI: InChI=1/C7H15ClO2/c1-2-3-4-10-6-7(9)5-8/h7,9H,2-6H2,1H3
InChIKey: IZHGMMBZJWHGND-UHFFFAOYAB
Std. InChI: InChI=1S/C7H15ClO2/c1-2-3-4-10-6-7(9)5-8/h7,9H,2-6H2,1H3
Std. InChIKey: IZHGMMBZJWHGND-UHFFFAOYSA-N
CAS NO: 16224-33-2
Molecular Formula: C7H15ClO2
Molecular Weight: 166.6458
Molecular Structure :
H bond acceptors: 2
H bond donors: 1
Freely Rotating Bonds: 7
Polar Surface Area: 18.46 Å2
Index of Refraction: 1.445
Molar Refractivity: 42.56 cm3
Molar Volume: 159.7 cm3
Surface Tension: 33 dyne/cm
Density: 1.043 g/cm3
Flash Point: 98.1 °C
Enthalpy of Vaporization: 55.26 kJ/mol
Boiling Point: 238.6 °C at 760 mmHg
Vapour Pressure: 0.00745 mmHg at 25°C
1. | skn-rbt 500 mg/24H MOD | 28ZPAK Sbornik Vysledku Toxixologickeho Vysetreni Latek A Pripravku Marhold, J.V.,Institut Pro Vychovu Vedoucicn Pracovniku Chemickeho Prumyclu Praha,Czechoslovakia.: 1972,81. | ||
2. | eye-rbt 250 µg/24H SEV | 28ZPAK Sbornik Vysledku Toxixologickeho Vysetreni Latek A Pripravku Marhold, J.V.,Institut Pro Vychovu Vedoucicn Pracovniku Chemickeho Prumyclu Praha,Czechoslovakia.: 1972,81. | ||
3. | orl-rat LD50:3520 mg/kg | 28ZPAK Sbornik Vysledku Toxixologickeho Vysetreni Latek A Pripravku Marhold, J.V.,Institut Pro Vychovu Vedoucicn Pracovniku Chemickeho Prumyclu Praha,Czechoslovakia.: 1972,81. |
Reported in EPA TSCA Inventory.
Moderately toxic by ingestion. A skin and severe eye irritant. See also ETHERS. When Butyl 3-chloro-2-hydroxypropyl ether (CAS NO.16224-33-2 ) is heated to decomposition, it emits toxic fumes of Cl−.