Name: Name:1H-Pyrrolo[2,3-b]pyridine, 4-nitro-3-(trifluoroMethyl)-, 7-oxide
Brand: Angene
SKU: AG00GTY8
Rating: 90 (10 reviews)

1H-Pyrrolo[2,3-b]pyridine, 4-nitro-3-(trifluoroMethyl)-, 7-oxide

CAS No.:

892414-49-2

Catalog Number:

AG00GTY8

Molecular Formula:

C8H4F3N3O3

Molecular Weight:

247.1309

Catalog Number:

AG00GTY8

Chemical Name:

1H-Pyrrolo[2,3-b]pyridine, 4-nitro-3-(trifluoroMethyl)-, 7-oxide

CAS Number:

892414-49-2

Molecular Formula:

C8H4F3N3O3

Molecular Weight:

247.1309

MDL Number:

MFCD23106217

IUPAC Name:

7-hydroxy-4-nitro-3-(trifluoromethyl)pyrrolo[2,3-b]pyridine

InChI:

InChI=1S/C8H4F3N3O3/c9-8(10,11)4-3-12-7-6(4)5(14(16)17)1-2-13(7)15/h1-3,15H

InChI Key:

ITBJCWHSRBFHDW-UHFFFAOYSA-N

SMILES:

[O-][N+](=O)c1ccn(=O)c2c1c(c[nH]2)C(F)(F)F

Complexity:

319

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

247.02g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

247.133g/mol

Monoisotopic Mass:

247.02g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

83.9A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.8