sales@angenesci.com
Login | Register
logo
Structures Search
Home Other Building Blocks 2,3,5,6-Tetrafluoroanisole

2,3,5,6-Tetrafluoroanisole

CAS No.:
2324-98-3
Catalog Number:
AG002MN2
Molecular Formula:
C7H4F4O
Molecular Weight:
180.0997
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$25
- +
5g
95%
In Stock USA
United States
$63
- +
25g
95%
In Stock USA
United States
$188
- +
100g
95%
In Stock USA
United States
$563
- +
Product Description
Catalog Number:
AG002MN2
Chemical Name:
2,3,5,6-Tetrafluoroanisole
CAS Number:
2324-98-3
Molecular Formula:
C7H4F4O
Molecular Weight:
180.0997
MDL Number:
MFCD00000311
IUPAC Name:
1,2,4,5-tetrafluoro-3-methoxybenzene
InChI:
InChI=1S/C7H4F4O/c1-12-7-5(10)3(8)2-4(9)6(7)11/h2H,1H3
InChI Key:
AXCOCGJDERQVDK-UHFFFAOYSA-N
SMILES:
COc1c(F)c(F)cc(c1F)F
EC Number:
219-037-0
NSC Number:
96891
Properties
Complexity:
140  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
180.02g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
180.102g/mol
Monoisotopic Mass:
180.02g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Literature
Title Journal
Molecular structure and internal rotation in 2,3,5,6-tetrafluoroanisole as studied by gas-phase electron diffraction and quantum chemical calculations. The journal of physical chemistry. A 20050120
Properties