Home Halogens 4-Ethylbenzotrifluoride

4-Ethylbenzotrifluoride

CAS No.:
27190-69-8
Catalog Number:
AG00BGYA
Molecular Formula:
Molecular Weight:
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
1 week
United States
$121
- +
1g
95%
1 week
United States
$199
- +
5g
95%
1 week
United States
$725
- +
25g
95%
1 week
United States
$2809
- +
Product Description
Catalog Number:
AG00BGYA
Chemical Name:
4-Ethylbenzotrifluoride
CAS Number:
27190-69-8
MDL Number:
MFCD11100540
IUPAC Name:
1-ethyl-4-(trifluoromethyl)benzene
InChI:
InChI=1S/C9H9F3/c1-2-7-3-5-8(6-4-7)9(10,11)12/h3-6H,2H2,1H3
InChI Key:
IHHXYTIKYUHTQU-UHFFFAOYSA-N
Properties
Complexity:
131  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
174.066g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
174.166g/mol
Monoisotopic Mass:
174.066g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7  
Literature
Title Journal
P1 Phenethyl peptide boronic acid inhibitors of HCV NS3 protease. Bioorganic & medicinal chemistry letters 20021104
Properties