Name: Name:5-[(4-bromo-1H-pyrazol-1-yl)methyl]-1-methyl-1H-1,2,4-triazole
Brand: Angene
SKU: AG01AFPT
Rating: 90 (10 reviews)

5-[(4-bromo-1H-pyrazol-1-yl)methyl]-1-methyl-1H-1,2,4-triazole

CAS No.:

1464837-83-9

Catalog Number:

AG01AFPT

Molecular Formula:

C7H8BrN5

Molecular Weight:

242.0759

Catalog Number:

AG01AFPT

Chemical Name:

5-[(4-bromo-1H-pyrazol-1-yl)methyl]-1-methyl-1H-1,2,4-triazole

CAS Number:

1464837-83-9

Molecular Formula:

C7H8BrN5

Molecular Weight:

242.0759

MDL Number:

MFCD21269070

IUPAC Name:

5-[(4-bromopyrazol-1-yl)methyl]-1-methyl-1,2,4-triazole

InChI:

InChI=1S/C7H8BrN5/c1-12-7(9-5-11-12)4-13-3-6(8)2-10-13/h2-3,5H,4H2,1H3

InChI Key:

UQRBADZWAMVMIN-UHFFFAOYSA-N

SMILES:

Cn1ncnc1Cn1cc(cn1)Br

Complexity:

178

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

240.996g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

242.08g/mol

Monoisotopic Mass:

240.996g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

48.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.6