200,000+ products from a single source!
sales@angenechem.com
88427-07-0 | 1H-1,2,4-Triazole, 1-[3-chloro-3-(4-methylphenyl)-2-phenyl-2-propenyl]-
CAS No: 88427-07-0 Catalog No: AG004HQI MDL No:
Product Description
Catalog Number:
AG004HQI
Chemical Name:
1H-1,2,4-Triazole, 1-[3-chloro-3-(4-methylphenyl)-2-phenyl-2-propenyl]-
CAS Number:
88427-07-0
Molecular Formula:
C18H16ClN3
Molecular Weight:
309.7927
IUPAC Name:
1-[3-chloro-3-(4-methylphenyl)-2-phenylprop-2-enyl]-1,2,4-triazole
InChI:
InChI=1S/C18H16ClN3/c1-14-7-9-16(10-8-14)18(19)17(11-22-13-20-12-21-22)15-5-3-2-4-6-15/h2-10,12-13H,11H2,1H3
InChI Key:
RJMJHQZOBIYNHM-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)C(=C(c1ccccc1)Cn1cncn1)Cl
Properties
Complexity:
382
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
309.103g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
309.797g/mol
Monoisotopic Mass:
309.103g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
30.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
4.9
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.