200,000+ products from a single source!
sales@angenechem.com
87428-02-2 | 1,2,4-Triazin-6(1H)-one, 3-(3-chlorophenyl)-2,5-dihydro-
CAS No: 87428-02-2 Catalog No: AG004G6E MDL No:
Product Description
Catalog Number:
AG004G6E
Chemical Name:
1,2,4-Triazin-6(1H)-one, 3-(3-chlorophenyl)-2,5-dihydro-
CAS Number:
87428-02-2
Molecular Formula:
C9H8ClN3O
Molecular Weight:
209.6323
IUPAC Name:
3-(3-chlorophenyl)-2,5-dihydro-1H-1,2,4-triazin-6-one
InChI:
InChI=1S/C9H8ClN3O/c10-7-3-1-2-6(4-7)9-11-5-8(14)12-13-9/h1-4H,5H2,(H,11,13)(H,12,14)
InChI Key:
DMGVUMZPLRHXLF-UHFFFAOYSA-N
SMILES:
O=C1CN=C(NN1)c1cccc(c1)Cl
Properties
Complexity:
267
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
209.036g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
209.633g/mol
Monoisotopic Mass:
209.036g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
53.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.