Home Halogens (1R)-2-Chloro-1-(2,4-dichlorophenyl)ethanol

(1R)-2-Chloro-1-(2,4-dichlorophenyl)ethanol

CAS No.:
114446-57-0
Catalog Number:
AG000EEO
Molecular Formula:
C8H7Cl3O
Molecular Weight:
225.4996
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95%
In Stock USA
United States
$91
- +
250mg
95%
In Stock USA
United States
$164
- +
1g
95%
In Stock USA
United States
$285
- +
Product Description
Catalog Number:
AG000EEO
Chemical Name:
(1R)-2-Chloro-1-(2,4-dichlorophenyl)ethanol
CAS Number:
114446-57-0
Molecular Formula:
C8H7Cl3O
Molecular Weight:
225.4996
MDL Number:
MFCD09863567
IUPAC Name:
(1R)-2-chloro-1-(2,4-dichlorophenyl)ethanol
InChI:
InChI=1S/C8H7Cl3O/c9-4-8(12)6-2-1-5(10)3-7(6)11/h1-3,8,12H,4H2/t8-/m0/s1
InChI Key:
XHEPANNURIQWRM-QMMMGPOBSA-N
SMILES:
ClC[C@@H](c1ccc(cc1Cl)Cl)O
Properties
Complexity:
142  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
223.956g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
225.493g/mol
Monoisotopic Mass:
223.956g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Literature
Title Journal
Asymmetric chemoenzymatic synthesis of miconazole and econazole enantiomers. The importance of chirality in their biological evaluation. The Journal of organic chemistry 20110401
Properties