(1R)-3-Chloro-1-phenyl-propan-1-ol
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(1R)-3-Chloro-1-phenyl-propan-1-ol
structure -
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CAS No:
100306-33-0
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Formula:
C9H11ClO
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Chemical Name:
(1R)-3-Chloro-1-phenyl-propan-1-ol
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Synonyms:
(R)-(+)-3-CHLORO-1-PHENYL-1-PR;α-(2-Chloroethyl)benzyl alcohol, (R)-(+)-α-(2-Chloroethyl)benzyl alcohol, (R)-(+)-3-Chloro-1-phenylpropanol;Dapoxetine hydrochloride Impurity M;(1R)-3-Chloro-1-Phenyl-Propan-1-ol (R)-(+)-3;Benzenemethanol, α-(2-chloroethyl)-, (αR)-;R-(+)-1-chloro-3-hydroxy-3-phenylpropane;(αR)-α-(2-Chloroethyl)benzeneMethanol;(R)-(+)-3-CHLORO-1-PHENYLPROPANOL((R)-3-chloro-1-phenylpropan-1-ol)
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CAS No:
(1R)-3-Chloro-1-phenyl-propan-1-ol Basic Attributes
170.64
170.049850
5250766
627-168-3
DTXSID50349017
White to yellow
29062990
Characteristics
20.2
2
off-white cryst
1.149±0.06 g/cm3(Predicted)
58-60 °C (lit.)
296.4±20.0 °C(Predicted)
132.0±17.2 °C
1.544
0.000651mmHg at 25°C
13.92±0.20(Predicted)
Inert atmosphere,Room Temperature
Safety Information
IRRITANT
NONH for all modes of transport
3
Xi
26-36
Xi
P261-P305 + P351 + P338
36/37/38
|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 41 companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
(1R)-3-Chloro-1-phenyl-propan-1-ol Use and Manufacturing
Intermediate in the preparation of (S)-Norfluoxetine
(R)-(+)-3-Chloro-1-phenyl-1-propanol may be used as a building block in the synthesis of antidepressants such as (R)- and (S)-tomoxetine, fluoxetine and nisoxetine. It may also be used in the synthesis of biologically active 2-substituted chromans such as tephrowatsin E.
Computed Properties
Molecular Weight:170.63
XLogP3:2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:3
Exact Mass:170.0498427
Monoisotopic Mass:170.0498427
Topological Polar Surface Area:20.2
Heavy Atom Count:11
Complexity:99.7
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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(1R)-3-Chloro-1-phenyl-propan-1-ol
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