200,000+ products from a single source!
sales@angenechem.com
1072944-90-1 | 5-Amino-3-methyl-1-(2,3,5,6-tetrafluorophenyl);-1H-pyrazole-4-carbonitrile
CAS No: 1072944-90-1 Catalog No: AG003MDR MDL No:MFCD11504942
Product Description
Catalog Number:
AG003MDR
Chemical Name:
5-Amino-3-methyl-1-(2,3,5,6-tetrafluorophenyl);-1H-pyrazole-4-carbonitrile
CAS Number:
1072944-90-1
Molecular Formula:
C11H6F4N4
Molecular Weight:
270.1858
MDL Number:
MFCD11504942
IUPAC Name:
5-amino-3-methyl-1-(2,3,5,6-tetrafluorophenyl)pyrazole-4-carbonitrile
InChI:
InChI=1S/C11H6F4N4/c1-4-5(3-16)11(17)19(18-4)10-8(14)6(12)2-7(13)9(10)15/h2H,17H2,1H3
InChI Key:
QHVYINIYGHMDKC-UHFFFAOYSA-N
SMILES:
N#Cc1c(C)nn(c1N)c1c(F)c(F)cc(c1F)F
Properties
Complexity:
372
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
270.053g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
270.191g/mol
Monoisotopic Mass:
270.053g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
67.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.