Products
  • Products
  • Buy offers
  • Encyclopedia
  • Msds lib
  • Synthesis
  • Reach Info
  • Suppliers
Home> Hot Product Listed 3   > 3-(dimethylamino)-1,1-diphenylbutan-1-ol hydrochloride (1:1)
904745-61-5 structure

3-(dimethylamino)-1,1-diphenylbutan-1-ol hydrochloride (1:1)

Iupac Name:5-(bromomethyl)-2-chloro-3-fluoropyridine
CAS No.:904745-61-5
Molecular Weight:224.457
Molecular Formula:C3H3CL2FO (isomer)
Names and Identifiers
Synonyms

1-Butanol, 3-(N,N-dimethylamino)-1,1-diphenyl-, hydrochloride 1-Butanol,3-dimethylamino-1,1-diphenyl-, hydrochloride 3-(dimethylamino)-1,1-diphenylbutan-1-ol hydrochloride 3-(dimethylamino)-1,1-diphenylbutan-1-ol hydrochloride(1:1) 3-Dimethylamino-1,1-diphenyl-1-butanol hydrochloride AC1L31T8 AC1Q3F2C alpha-(2-(Dimethylamino)propyl)benzhydrol hydrochloride AR-1E7563 Benzhydrol, alpha-(2-(dimethylamino)propyl)-, hydrochloride LS-32379

Inchi
InChI=1S/C6H4BrClFN/c7-2-4-1-5(9)6(8)10-3-4/h1,3H,2H2
InChkey
JIHHGLWJEUIQOP-UHFFFAOYSA-N
Canonical Smiles
C1=C(C=NC(=C1F)Cl)CBr
Properties
Flash Point
133.8°C
MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

no data available

2.2 GHS label elements, including precautionary statements

Pictogram(s) no data available
Signal word

no data available

Hazard statement(s)

no data available

Precautionary statement(s)
Prevention

no data available

Response

no data available

Storage

no data available

Disposal

no data available

2.3 Other hazards which do not result in classification

no data available

Computational chemical data
  • Molecular Weight:224.457g/mol
  • Molecular Formula:C3H3CL2FO
  • Compound Is Canonicalized:True
  • Exact Mass:222.92
  • Monoisotopic Mass:222.92
  • Complexity:114
  • Rotatable Bond Count:1
  • Hydrogen Bond Donor Count:0
  • Hydrogen Bond Acceptor Count:2
  • Topological Polar Surface Area:12.9A^2
  • Heavy Atom Count:10
  • Defined Atom Stereocenter Count:0
  • Undefined Atom Stereocenter Count:0
  • Defined Bond Stereocenter Count:0
  • Undefined Bond Stereocenter Count:0
  • Isotope Atom Count:0
  • Covalently-Bonded Unit Count:1
  • CACTVS Substructure Key Fingerprint: AAADcYBiAQAEEAAAAAAAAAAAAAAAAAAAAAAsAAAAAAAAAAABgAAAHQJAAAABTALBGiw8gJIIEACg AjBnRACCgCAxBCAA2CAoRrgIIOLBk5GEIAhggADIyBYQAAAMAAAAAAAAAAAAAAAAAAAAAAAAAAAA AA==
 
<