Name: Name:6-bromopyrrolo[1,2-d][1,2,4]triazin-4(3H)-one
Brand: Angene
SKU: AG01DWNI
Rating: 90 (10 reviews)

6-bromopyrrolo[1,2-d][1,2,4]triazin-4(3H)-one

CAS No.:

75841-27-9

Catalog Number:

AG01DWNI

Molecular Formula:

C6H4BrN3O

Molecular Weight:

214.0195

Catalog Number:

AG01DWNI

Chemical Name:

6-bromopyrrolo[1,2-d][1,2,4]triazin-4(3H)-one

CAS Number:

75841-27-9

Molecular Formula:

C6H4BrN3O

Molecular Weight:

214.0195

MDL Number:

MFCD11973831

IUPAC Name:

6-bromo-3H-pyrrolo[1,2-d][1,2,4]triazin-4-one

InChI:

InChI=1S/C6H4BrN3O/c7-5-2-1-4-3-8-9-6(11)10(4)5/h1-3H,(H,9,11)

InChI Key:

BJXHMNXTYPQURK-UHFFFAOYSA-N

SMILES:

Brc1ccc2n1c(=O)[nH]nc2

Complexity:

218

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

212.954g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

214.022g/mol

Monoisotopic Mass:

212.954g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

46.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.2