200,000+ products from a single source!

sales@angenechem.com

Home > Bromides > 918339-63-6

918339-63-6

918339-63-6 | 1H-Pyrazole, 4-bromo-1-(4-methoxyphenyl)-5-(trifluoromethyl)-

CAS No: 918339-63-6 Catalog No: AG006GAK MDL No:

Product Description

Catalog Number:
AG006GAK
Chemical Name:
1H-Pyrazole, 4-bromo-1-(4-methoxyphenyl)-5-(trifluoromethyl)-
CAS Number:
918339-63-6
Molecular Formula:
C11H8BrF3N2O
Molecular Weight:
321.0932
IUPAC Name:
4-bromo-1-(4-methoxyphenyl)-5-(trifluoromethyl)pyrazole
InChI:
InChI=1S/C11H8BrF3N2O/c1-18-8-4-2-7(3-5-8)17-10(11(13,14)15)9(12)6-16-17/h2-6H,1H3
InChI Key:
ZDLFJIYTFXBIRF-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)n1ncc(c1C(F)(F)F)Br

Properties

Complexity:
282  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
319.977g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
321.097g/mol
Monoisotopic Mass:
319.977g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
27A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5  

Related Products

© 2019 Angene International Limited. All rights Reserved.