200,000+ products from a single source!
sales@angenechem.com
100553-84-2 | 3H-Pyrazol-3-one, 2-(3,5-dichlorophenyl)-2,4-dihydro-5-methyl-
CAS No: 100553-84-2 Catalog No: AG0002C3 MDL No:
Product Description
Catalog Number:
AG0002C3
Chemical Name:
3H-Pyrazol-3-one, 2-(3,5-dichlorophenyl)-2,4-dihydro-5-methyl-
CAS Number:
100553-84-2
Molecular Formula:
C10H8Cl2N2O
Molecular Weight:
243.0893
IUPAC Name:
2-(3,5-dichlorophenyl)-5-methyl-4H-pyrazol-3-one
InChI:
InChI=1S/C10H8Cl2N2O/c1-6-2-10(15)14(13-6)9-4-7(11)3-8(12)5-9/h3-5H,2H2,1H3
InChI Key:
VKTHFHQABGJLCW-UHFFFAOYSA-N
SMILES:
O=C1CC(=NN1c1cc(Cl)cc(c1)Cl)C
Properties
Complexity:
296
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.001g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
243.087g/mol
Monoisotopic Mass:
242.001g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
32.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.