Name: Name:4-benzyl-3-chloro-5-phenyl-4H-1,2,4-triazole
Brand: Angene
SKU: AG019MQW
Rating: 90 (10 reviews)

4-benzyl-3-chloro-5-phenyl-4H-1,2,4-triazole

CAS No.:

1020043-28-0

Catalog Number:

AG019MQW

Molecular Formula:

C15H12ClN3

Molecular Weight:

269.7289

Catalog Number:

AG019MQW

Chemical Name:

4-benzyl-3-chloro-5-phenyl-4H-1,2,4-triazole

CAS Number:

1020043-28-0

Molecular Formula:

C15H12ClN3

Molecular Weight:

269.7289

MDL Number:

MFCD09995976

IUPAC Name:

4-benzyl-3-chloro-5-phenyl-1,2,4-triazole

InChI:

InChI=1S/C15H12ClN3/c16-15-18-17-14(13-9-5-2-6-10-13)19(15)11-12-7-3-1-4-8-12/h1-10H,11H2

InChI Key:

MYRBSCDFIIDPDV-UHFFFAOYSA-N

SMILES:

Clc1nnc(n1Cc1ccccc1)c1ccccc1

Complexity:

275

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

269.072g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

269.732g/mol

Monoisotopic Mass:

269.072g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

30.7A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.6