Name: Name:2-(5-Bromo-1H-indazol-3-yl)acetonitrile
Brand: Angene
SKU: AG00HU0F
Rating: 90 (10 reviews)

2-(5-Bromo-1H-indazol-3-yl)acetonitrile

CAS No.:

1352887-90-1

Catalog Number:

AG00HU0F

Molecular Formula:

C9H6BrN3

Molecular Weight:

236.0680

Catalog Number:

AG00HU0F

Chemical Name:

2-(5-Bromo-1H-indazol-3-yl)acetonitrile

CAS Number:

1352887-90-1

Molecular Formula:

C9H6BrN3

Molecular Weight:

236.0680

MDL Number:

MFCD22553132

IUPAC Name:

2-(5-bromo-2H-indazol-3-yl)acetonitrile

InChI:

InChI=1S/C9H6BrN3/c10-6-1-2-8-7(5-6)9(3-4-11)13-12-8/h1-2,5H,3H2,(H,12,13)

InChI Key:

RPIYPKMKTJJQST-UHFFFAOYSA-N

SMILES:

Brc1cc2c(CC#N)n[nH]c2cc1

Complexity:

234

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

234.975g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

236.072g/mol

Monoisotopic Mass:

234.975g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

52.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.9