Name: Name:5-[(2-chloro-6-fluorophenyl)methyl]-3-phenyl-1H-1,2,4-triazole
Brand: Angene
SKU: AG01ACZV
Rating: 90 (10 reviews)

5-[(2-chloro-6-fluorophenyl)methyl]-3-phenyl-1H-1,2,4-triazole

CAS No.:

1308236-60-3

Catalog Number:

AG01ACZV

Molecular Formula:

C15H11ClFN3

Molecular Weight:

287.7193

Catalog Number:

AG01ACZV

Chemical Name:

5-[(2-chloro-6-fluorophenyl)methyl]-3-phenyl-1H-1,2,4-triazole

CAS Number:

1308236-60-3

Molecular Formula:

C15H11ClFN3

Molecular Weight:

287.7193

MDL Number:

MFCD26936198

IUPAC Name:

5-[(2-chloro-6-fluorophenyl)methyl]-3-phenyl-1H-1,2,4-triazole

InChI:

InChI=1S/C15H11ClFN3/c16-12-7-4-8-13(17)11(12)9-14-18-15(20-19-14)10-5-2-1-3-6-10/h1-8H,9H2,(H,18,19,20)

InChI Key:

MEMONQURYKAVOT-UHFFFAOYSA-N

SMILES:

Fc1cccc(c1Cc1[nH]nc(n1)c1ccccc1)Cl

Complexity:

312

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

287.063g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

287.722g/mol

Monoisotopic Mass:

287.063g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

41.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

4.3