Name: Name:3-(4-bromophenyl)-5-methyl-1H-1,2,4-triazole
Brand: Angene
SKU: AG01AAOC
Rating: 90 (10 reviews)

3-(4-bromophenyl)-5-methyl-1H-1,2,4-triazole

CAS No.:

170230-86-1

Catalog Number:

AG01AAOC

Molecular Formula:

C9H8BrN3

Molecular Weight:

238.0839

Catalog Number:

AG01AAOC

Chemical Name:

3-(4-bromophenyl)-5-methyl-1H-1,2,4-triazole

CAS Number:

170230-86-1

Molecular Formula:

C9H8BrN3

Molecular Weight:

238.0839

MDL Number:

MFCD17167250

IUPAC Name:

3-(4-bromophenyl)-5-methyl-1H-1,2,4-triazole

InChI:

InChI=1S/C9H8BrN3/c1-6-11-9(13-12-6)7-2-4-8(10)5-3-7/h2-5H,1H3,(H,11,12,13)

InChI Key:

OWYRSIQJIFJFIV-UHFFFAOYSA-N

SMILES:

Brc1ccc(cc1)c1n[nH]c(n1)C

Complexity:

168

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

236.99g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

238.088g/mol

Monoisotopic Mass:

236.99g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

41.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.7