200,000+ products from a single source!
sales@angenechem.com
50562-01-1 | 1-Methyl-4-(2,2,2-trifluoroethyl)benzene
CAS No: 50562-01-1 Catalog No: AG01EW99 MDL No:
Product Description
Catalog Number:
AG01EW99
Chemical Name:
1-Methyl-4-(2,2,2-trifluoroethyl)benzene
CAS Number:
50562-01-1
Molecular Formula:
C9H9F3
Molecular Weight:
174.1630
IUPAC Name:
1-methyl-4-(2,2,2-trifluoroethyl)benzene
InChI:
InChI=1S/C9H9F3/c1-7-2-4-8(5-3-7)6-9(10,11)12/h2-5H,6H2,1H3
InChI Key:
DSJJCEACYWFWAH-UHFFFAOYSA-N
SMILES:
FC(Cc1ccc(cc1)C)(F)F
NSC Number:
142233
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
Related Products
© 2019 Angene International Limited. All rights Reserved.