ChemicalBook > CAS DataBase List > 3-(3-(Trifluoromethyl)phenyl)propan-1-ol

3-(3-(Trifluoromethyl)phenyl)propan-1-ol

Product Name
3-(3-(Trifluoromethyl)phenyl)propan-1-ol
CAS No.
78573-45-2
Chemical Name
3-(3-(Trifluoromethyl)phenyl)propan-1-ol
Synonyms
Cinacalcet I;Cinacalcet USP RC E;Sinacase Impurity 48;Cinacalcet InterMediates;Cinacalcet Intermediate 1;CICALCET-ALCOHOL IMPURITY;Cinacalcet Alcohol Impurity;Cinacalcet Related Compound E;Cinacalcet USP Related Compound E;Cinacalcet Hydrochloride iMpuritL
CBNumber
CB4842637
Molecular Formula
C10H11F3O
Formula Weight
204.19
MOL File
78573-45-2.mol
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3-(3-(Trifluoromethyl)phenyl)propan-1-ol Property

Boiling point:
68-71℃/0.4mm
Density 
1.10
refractive index 
1.4620 to 1.4660
storage temp. 
Sealed in dry,Room Temperature
solubility 
DMSO (Slightly), Methanol (Slightly)
pka
15.04±0.10(Predicted)
form 
Liquid
color 
Colorless
InChI
InChI=1S/C10H11F3O/c11-10(12,13)9-5-1-3-8(7-9)4-2-6-14/h1,3,5,7,14H,2,4,6H2
InChIKey
QWXKQVIMGVVIBX-UHFFFAOYSA-N
SMILES
C1(CCCO)=CC=CC(C(F)(F)F)=C1
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Safety

HS Code 
2906290090
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Hazard and Precautionary Statements (GHS)

Symbol(GHS)
Signal word
Warning
Hazard statements

H302Harmful if swallowed

H315Causes skin irritation

H319Causes serious eye irritation

H335May cause respiratory irritation

Precautionary statements

P261Avoid breathing dust/fume/gas/mist/vapours/spray.

P305+P351+P338IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.

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N-Bromosuccinimide Price

TCI Chemical
Product number
T3095
Product name
3-[3-(Trifluoromethyl)phenyl]-1-propanol
Purity
>98.0%(GC)
Packaging
1g
Price
$43
Updated
2025/07/31
TCI Chemical
Product number
T3095
Product name
3-[3-(Trifluoromethyl)phenyl]-1-propanol
Purity
>98.0%(GC)
Packaging
5g
Price
$168
Updated
2025/07/31
TRC
Product number
T791110
Product name
3-(Trifluoromethyl)benzenepropanol
Packaging
5g
Price
$460
Updated
2021/12/16
Medical Isotopes, Inc.
Product number
13993
Product name
3-(Trifluoromethyl)benzenepropanol
Packaging
1.25g
Price
$1960
Updated
2021/12/16
ChemScene
Product number
CS-M0619
Product name
3-(3-(trifluoromethyl)phenyl)propan-1-ol
Purity
99.94%
Packaging
100g
Price
$366
Updated
2021/12/16
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3-(3-(Trifluoromethyl)phenyl)propan-1-ol Chemical Properties,Usage,Production

Chemical Properties

Brown Oil

Uses

3-(Trifluoromethyl)benzenepropanol-d4 is an intermediate in the synthesis of Cinacalcet-d4 Hydrochloride (C441803), a labeled analogue of Cinacalcet Hydrochloride (C441800), the (R) enantiomer of Cinacalcet which is used in clinical trial in secondary hyperparathyroidism.

Definition

ChEBI: 3-[3-(trifluoromethyl)phenyl]propan-1-ol is an organofluorine compound that is 3-phenylpropan-1-ol bearing a trifluoromethyl group at position 3 on the phenyl ring. It is an organofluorine compound and a member of propan-1-ols.

Synthesis

65126-85-4

78573-45-2

To a solution of 14.5 g (72.5 mmol) of purified 3-(3-trifluoromethylphenyl)propargyl alcohol in 50 mL of 2-propanol was added 0.38 g of 10% Pd/C (Selcat Q6). The reaction mixture was subjected to hydrogenation at a temperature of 42-45°C and a pressure of 5 bar until all feedstocks were completely converted (about 5 hours). Upon completion of the reaction, it was filtered to remove the catalyst and the catalyst was washed with a small amount of 2-propanol. Subsequently, the filtrate was concentrated by evaporation under reduced pressure. The crude product obtained (14.5 g, 100.0%) was purified by distillation under reduced pressure, resulting in 10.5 g (yield: 72.1%) of the target product 3-(3-trifluoromethylphenyl)propanol as an almost colorless oil (boiling point: 58-60 °C/1.1-1.5 mbar).

References

[1] Organic Letters, 2019, vol. 21, # 1, p. 65 - 69
[2] Patent: US2010/267988, 2010, A1. Location in patent: Page/Page column 4
[3] Patent: EP2327684, 2011, A1. Location in patent: Page/Page column 6
[4] Patent: US2011/124917, 2011, A1. Location in patent: Page/Page column 3

3-(3-(Trifluoromethyl)phenyl)propan-1-ol Preparation Products And Raw materials

Raw materials

Preparation Products

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View Lastest Price from 3-(3-(Trifluoromethyl)phenyl)propan-1-ol manufacturers

WUHAN FORTUNA CHEMICAL CO., LTD
Product
3-(3'-Trifluoromethylphenyl)propanol 78573-45-2
Price
US $0.00-0.00/Kg/Drum
Min. Order
1KG
Purity
98%min
Supply Ability
10000KGS
Release date
2021-11-08
Hebei Chuanghai Biotechnology Co., Ltd
Product
3-(3'-TRIFLUOROMETHYL PHENYL) PROPANOL 78573-45-2
Price
US $0.00-0.00/KG
Min. Order
1KG
Purity
99%
Supply Ability
500000kg
Release date
2024-10-29
Henan Aochuang Chemical Co.,Ltd.
Product
3-(3'-TRIFLUOROMETHYL PHENYL) PROPANOL 78573-45-2
Price
US $0.00-0.00/kg
Min. Order
1kg
Purity
98%
Supply Ability
1Ton
Release date
2022-10-19

78573-45-2, 3-(3-(Trifluoromethyl)phenyl)propan-1-olRelated Search:

3-(3-Trifluoromethylphenyl)propionic acid 3-(3-TRIFLUOROMETHYL-PHENYL)-PROPIONALDEHYDE Cinacalcet Impurity B 4-(TRIFLUOROMETHYL)HYDROCINNAMIC ACID Cinacalcet Impurity 38 HCl (E)-m-(trifluoromethyl)cinnamic acid 1-NAPHTHALEN-2-YL-ETHYLAMINE Cinacalcet IMpurity 7 (R)-1-(Naphthalen-2-yl)ethanamine hydrochloride (1R)-1-(5-methylnaphthalen-1-yl)ethan-1-amine Cinacalcet IMpurity 3 Cinacalcet Impurity 46 3-(4-TRIFLUOROMETHYL-PHENYL)-PROPAN-1-OL Methanesulfonic acid 3-(3-trifluoroMethylphenyl)propyl ester cinacalcet iMpurity 4 N-(1-(naphthalen-1-yl)ethyl)forMaMide Cinacalcet impurity C Cinacalcet Impurity 45

  • 3-(3'-TRIFLUOROMETHYL PHENYL) PROPANOL
  • 3-(3-TRIFLUOROMETHYL-PHENYL)-PROPAN-1-OL
  • 3-(Trifluoromethyl)benzenepropanol
  • Cinacalcet Intermediate 1
  • Cinacalcet I
  • Cinacalcet InterMediates
  • 3-(3-(trifluoroMrthyl)pheny1)propan-1-ol
  • 3-(3-Hydroxyprop-1-yl)benzotrifluoride, 3-(3-Hydroxyprop-1-yl)-alpha,alpha,alpha-trifluorotoluene
  • Benzenepropanol,3-(trifluoroMethyl)-
  • 3-[3-(Trifluoromethyl)phenyl]-1-propanol
  • Cinacalcet USP RC E
  • Cinacalcet USP Related Compound E
  • Cinacalcet Alcohol Impurity
  • Cinacalcet Hydrochloride iMpuritL
  • Cinacalcet Related Compound E
  • CICALCET-ALCOHOL IMPURITY
  • 3-(Trifluoromethyl)cinnamic propional
  • -Trifluoromethyl Phenyl) Propanol
  • 3-(3-Trifluoromethylphenyl)propanol, 3-(3'-Trifluoromethyl Phenyl) Propanol, 3-(3-(Trifluoromethyl)phenyl)-propan-1-ol, 3-(Trifluoromethyl)benzenepropanol, 3-(3-(trifluoromethyl)phenyl)propan-1-ol, 3-(3-Hydroxyprop-1-yl)benzotrifluoride, 3-(3-Hydroxyprop-1-yl)-alpha,alpha,alpha-trifluorotoluene, Cinacalcet Intermediates
  • Sinacase Impurity 48
  • 3-(3-Trifluoromethylphenyl)propanol, 3-(3'-Trifluoromethyl Phenyl) Propanol, 3-(3-(Trifluoromethyl)phenyl)-propan-1-ol, 3-(Trifluoromethyl)benzenepropanol, 3-(3-(trifluoromethyl)phenyl)propan-1-ol, 3-(3-Hydroxyprop-1-yl)benzotrifluoride, 3-(3-Hydroxyprop-1-yl)-alpha,alpha,alpha-trifluorotoluene, Cinacalcet Intermediates
  • 3-(3-(Tri?uoromethyl)phenyl) propan-1-ol
  • 3-(3-Trifluoromethylphenyl)propanol CAS：78573-45-2
  • 3-Trifluoromethylphenylpropyl alcohol
  • 7-(4-Chlorobutoxy)quinolin-2(1H)-one (Intermediate of Brexpiprazole)
  • 78573-45-2
  • 9553671-05-8
  • Cinacalcet Intermediate
  • Aromatics Compounds
  • Aromatics
  • Intermediates