1-(2-Chlorophenyl)-3-(dimethylamino)-1-phenyl-1-propanol | CAS No. 791-35-5

1-(2-Chlorophenyl)-3-(dimethylamino)-1-phenyl-1-propanol

Basic Information

CAS Number

791-35-5

Molecular Formula

C17H20ClNO

Molecular Weight

289.81 g/mol

AD

Basic Physical Properties

Melting Point

125 ºC (ethyl acetate ligroine (1:1))

Density

1.148±0.06 g/cm3 (20 ºC 760 Torr),

CN(C)CCC(C1=CC=CC=C1)(C2=CC=CC=C2Cl)O

InChI

InChI=1S/C17H20ClNO/c1-19(2)13-12-17(20,14-8-4-3-5-9-14)15-10-6-7-11-16(15)18/h3-11,20H,12-13H2,1-2H3

InChIKey

WRCHFMBCVFFYEQ-UHFFFAOYSA-N

LogP

3.5276000000000023

Topological Polar Surface Area

23.47 Ų

Hydrogen Bond Donor/Acceptor

1 / 2

Complexity

291

Safety Information

View Safety Information

Toxicity

LD50 i.v. in mice: 70 mg/kg (Lorenz)

Synonyms & References

English

  • EN300-18567728
  • Benzhydrol, 2-chloro-.alpha.-[2-(dimethylamino)ethyl]-
  • SCHEMBL29734
  • 1-(2-Chlorophenyl)-1-phenyl-3-dimethylaminopropanol
  • 1-Phenyl-1-(o-chlorophenyl)-3-dimethylaminopropanol
  • WRCHFMBCVFFYEQ-UHFFFAOYSA-N
  • CHLOPHEDIANOL [VANDF]
  • DTXCID602789
  • AC-16003
  • 42C50P12AP
  • .alpha.-(Dimethylaminoethyl)-o-chlorobenzhydrol
  • 791-35-5
  • CAS-791-35-5
  • Clofedianolo
  • Benzenemethanol, 2-chloro-alpha-(2-(dimethylamino)ethyl)-alpha-phenyl- (9CI)
  • EINECS 212-340-9
  • CHEMBL1201313
  • SL 501 base
  • NSC-113595
  • Clofedanol (INN)
  • AKOS015962243
  • Calmotusin; Chlophedianol; Clofedanol; NSC 113595
  • 511-13-7 pound not791-35-5
  • Calmotusin
  • Benzenemethanol, 2-chloro-alpha-(2-(dimethylamino)ethyl)-alpha-phenyl-
  • Ulo base
  • Dencyl
  • Benzenemethanol, 2-chloro-.alpha.-[2-(dimethylamino)ethyl]-.alpha.-phenyl-
  • Clofedanol [INN:BAN]
  • Antitussin (TN)
  • Abehol

MDL Number

MFCD00866840

FAQ

What regulatory guidelines apply to 1-(2-Chlorophenyl)-3-(dimethylamino)-1-phenyl-1-propanol (CAS: 791-35-5)?

1-(2-Chlorophenyl)-3-(dimethylamino)-1-phenyl-1-propanol (CAS: 791-35-5) falls under various regulatory guidelines such as GHS classification, which includes hazards like flammability, reactivity, and toxicity. It is also subject to REACH regulations, ensuring safe use and handling, and may be regulated by the FDA and EPA for specific applications. Compliance with these guidelines is crucial to ensure safety and environmental protection.

Are there alternatives to 1-(2-Chlorophenyl)-3-(dimethylamino)-1-phenyl-1-propanol (CAS: 791-35-5) in synthesis?

Alternatives to 1-(2-Chlorophenyl)-3-(dimethylamino)-1-phenyl-1-propanol (CAS: 791-35-5) in synthesis include similar aromatic compounds with varying substituents. For instance, 1-(3-Chlorophenyl)-3-(dimethylamino)-1-phenyl-1-propanol or 1-(2-Iodophenyl)-3-(dimethylamino)-1-phenyl-1-propanol can be used as substitutes. Other alternatives may include isomers or analogs that offer similar functionality but with different reactivity profiles.

What is the market or research trend for 1-(2-Chlorophenyl)-3-(dimethylamino)-1-phenyl-1-propanol (CAS: 791-35-5)?

The market for 1-(2-Chlorophenyl)-3-(dimethylamino)-1-phenyl-1-propanol (CAS: 791-35-5) is driven by its use in pharmaceuticals and agrochemicals. Research trends are focusing on its potential as a starting material for synthesizing complex molecules. Market dynamics include a steady demand from the pharmaceutical industry, with emerging trends in green chemistry aiming to develop more sustainable and environmentally friendly processes for its production and use.

How should waste containing 1-(2-Chlorophenyl)-3-(dimethylamino)-1-phenyl-1-propanol (CAS: 791-35-5) be handled?

Waste containing 1-(2-Chlorophenyl)-3-(dimethylamino)-1-phenyl-1-propanol (CAS: 791-35-5) should be collected in appropriate containers and handled according to local and national regulations. Incineration is a common method for disposal, but professional waste disposal services are recommended to ensure safe and compliant disposal. Environmental protection precautions include minimizing exposure to air and water, and proper documentation of the disposal process to comply with environmental and occupational safety standards.

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