200,000+ products from a single source!
sales@angenechem.com
90766-91-9 | 4-Bromo-5-chloro-3-methyl-1-(4-nitro-phenyl)-1H-pyrazole
CAS No: 90766-91-9 Catalog No: AG01EYZV MDL No:
Product Description
Catalog Number:
AG01EYZV
Chemical Name:
4-Bromo-5-chloro-3-methyl-1-(4-nitro-phenyl)-1H-pyrazole
CAS Number:
90766-91-9
Molecular Formula:
C10H7BrClN3O2
Molecular Weight:
316.5385
IUPAC Name:
4-bromo-5-chloro-3-methyl-1-(4-nitrophenyl)pyrazole
InChI:
InChI=1S/C10H7BrClN3O2/c1-6-9(11)10(12)14(13-6)7-2-4-8(5-3-7)15(16)17/h2-5H,1H3
InChI Key:
DURYXFBIUHGLMF-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc(cc1)n1nc(c(c1Cl)Br)C
Properties
Complexity:
294
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
314.941g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
316.539g/mol
Monoisotopic Mass:
314.941g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
63.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.