Name: Name:1-[(2,6-difluorophenyl)methyl]-4-iodo-1H-1,2,3-triazole
Brand: Angene
SKU: AG01B5D8
Rating: 90 (10 reviews)

1-[(2,6-difluorophenyl)methyl]-4-iodo-1H-1,2,3-triazole

CAS No.:

1955540-09-6

Catalog Number:

AG01B5D8

Molecular Formula:

C9H6F2IN3

Molecular Weight:

321.0653

Catalog Number:

AG01B5D8

Chemical Name:

1-[(2,6-difluorophenyl)methyl]-4-iodo-1H-1,2,3-triazole

CAS Number:

1955540-09-6

Molecular Formula:

C9H6F2IN3

Molecular Weight:

321.0653

MDL Number:

MFCD30181040

IUPAC Name:

1-[(2,6-difluorophenyl)methyl]-4-iodotriazole

InChI:

InChI=1S/C9H6F2IN3/c10-7-2-1-3-8(11)6(7)4-15-5-9(12)13-14-15/h1-3,5H,4H2

InChI Key:

PGFOHKJPAASKEV-UHFFFAOYSA-N

SMILES:

Fc1cccc(c1Cn1nnc(c1)I)F

Complexity:

210

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

320.957g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

321.069g/mol

Monoisotopic Mass:

320.957g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

30.7A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.2