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CAS No.: | 37493-14-4 |
---|---|
Name: | (R)-(-)-2-Chloropropan-1-ol |
Article Data: | 9 |
Molecular Structure: | |
Formula: | C3H7ClO |
Molecular Weight: | 94.541 |
Synonyms: | 1-Propanol,2-chloro-, (R)-;(-)-(R)-2-Chloropropanol;(R)-(-)-2-Chloro-1-propanol;(R)-2-Chloro-1-propanol; |
Density: | 1.082 g/cm3 |
Boiling Point: | 133.5 °C at 760 mmHg |
Flash Point: | 44.4 °C |
Solubility: | soluble |
Appearance: | clear colourless liquid |
Hazard Symbols: | Xn |
Risk Codes: | 36/37/38-20/21/22-10 |
Safety: | 36/37/39-27-26-16 |
Transport Information: | UN 2611 |
PSA: | 20.23000 |
LogP: | 0.60600 |
(R)-ethyl 2-chloropropanoate
(R)-(-)-2-chloro-propan-1-ol
Conditions | Yield |
---|---|
With lithium aluminium tetrahydride In diethyl ether for 2h; | 78% |
With lithium aluminium tetrahydride In diethyl ether 1.) 0 deg C, 2.5 h; 2.) up to r.t. 15 h; | 35% |
With lithium aluminium tetrahydride In diethyl ether | |
With lithium aluminium tetrahydride In diethyl ether at 0℃; Heating; |
(S)-Ethyl lactate
(R)-(-)-2-chloro-propan-1-ol
Conditions | Yield |
---|---|
(i) PCl3, (ii) LiAlH4; Multistep reaction; |
(R)-2-chloropropionic acid
(R)-(-)-2-chloro-propan-1-ol
Conditions | Yield |
---|---|
With lithium aluminium tetrahydride In diethyl ether |
propene
A
(S)-2-chloropropan-1-ol
B
1-chloro-2(S)-hydroxypropane
C
(R)-(-)-1-chloro-2-propanol
D
(R)-(-)-2-chloro-propan-1-ol
Conditions | Yield |
---|---|
With copper dichloride; [Pd(CH3CN)2{(S)-BINAP}](BF4)2; 1,3-diacetyl acetone In tetrahydrofuran at 25℃; Product distribution; Further Variations:; Catalysts; Solvents; Reagents; |
2-chloropropanal
(R)-(-)-2-chloro-propan-1-ol
Conditions | Yield |
---|---|
With sodium tetrahydroborate In methanol |
(R)-(-)-2-chloro-propan-1-ol
Conditions | Yield |
---|---|
With potassium hydroxide In N,N-dimethyl-formamide at 100℃; | 93% |
p-toluenesulfonyl chloride
(R)-(-)-2-chloro-propan-1-ol
(R)-2-chloropropyl p-toluenesulfonate
Conditions | Yield |
---|---|
With pyridine 1.) 0 deg C, 1.5 h; 2.) up to r.t. 15 h; | 78% |
(R)-(-)-2-chloro-propan-1-ol
4-Ethoxycarbonyloxybenzoyl chloride
(R)-(2-Chloropropyl)-4-ethoxycarbonyloxybenzoate
Conditions | Yield |
---|---|
With potassium carbonate In diethyl ether for 5h; Heating; | 72.7% |
p-nitrocinnamic acid
(R)-(-)-2-chloro-propan-1-ol
Conditions | Yield |
---|---|
(i) SOCl2, (ii) /BRN= 6312547/, (iii) FeCl2, NH3; Multistep reaction; |
trifluoromethylsulfonic anhydride
(R)-(-)-2-chloro-propan-1-ol
(2R)-1-trifluoromethanesulfonyloxy-2-chloropropane
Conditions | Yield |
---|---|
With pyridine In dichloromethane at -60℃; | |
With pyridine In dichloromethane at -50℃; for 0.5h; | 11.7 g |
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The (R)-(-)-2-Chloropropan-1-ol with the CAS number 37493-14-4 is also called 1-Propanol, 2-chloro-,(2R)- (9CI). Both the systematic name and IUPAC name are (2R)-2-chloropropan-1-ol. Its molecular formula is C3H7ClO. This chemical belongs to the following product categories: (1)Chiral; (2)API intermediates.
The properties of the (R)-(-)-2-Chloropropan-1-ol are: (1)ACD/LogP: 0.27; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.27; (4)ACD/LogD (pH 7.4): 0.27; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 33.34; (8)ACD/KOC (pH 7.4): 33.34; (9)#H bond acceptors: 1; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 9.23 Å2; (13)Index of Refraction: 1.424; (14)Molar Refractivity: 22.29 cm3; (15)Molar Volume: 87.3 cm3; (16)Polarizability: 8.83×10-24cm3; (17)Surface Tension: 29.8 dyne/cm; (18)Enthalpy of Vaporization: 43.23 kJ/mol; (19)Vapour Pressure: 3.68 mmHg at 25°C.
While using this chemical, you should be very cautious. This chemical is flammable and harmful by inhalation, in contact with skin and if swallowed. It is not only irritating to skin, but also irritating to eyes and respiratory system. Therefore, you should take the following instructions. Firstly, you should wear suitable protective clothing, gloves and eye/face protection. Secondly in case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. Thirdly you should keep this chemical away from sources of ignition. Finally you should take off immediately all contaminated clothing.
You can still convert the following datas into molecular structure:
(1)SMILES: Cl[C@H](C)CO
(2)InChI: InChI=1/C3H7ClO/c1-3(4)2-5/h3,5H,2H2,1H3/t3-/m1/s1
(3)InChIKey: VZIQXGLTRZLBEX-GSVOUGTGBS