Name: Name:4-(5,6-difluoro-1H-1,3-benzodiazol-2-yl)aniline
Brand: Angene
SKU: AG01A04P
Rating: 90 (10 reviews)

4-(5,6-difluoro-1H-1,3-benzodiazol-2-yl)aniline

CAS No.:

1153806-57-5

Catalog Number:

AG01A04P

Molecular Formula:

C13H9F2N3

Molecular Weight:

245.2275

Catalog Number:

AG01A04P

Chemical Name:

4-(5,6-difluoro-1H-1,3-benzodiazol-2-yl)aniline

CAS Number:

1153806-57-5

Molecular Formula:

C13H9F2N3

Molecular Weight:

245.2275

MDL Number:

MFCD12414852

IUPAC Name:

4-(5,6-difluoro-1H-benzimidazol-2-yl)aniline

InChI:

InChI=1S/C13H9F2N3/c14-9-5-11-12(6-10(9)15)18-13(17-11)7-1-3-8(16)4-2-7/h1-6H,16H2,(H,17,18)

InChI Key:

CDDVSBYOTUYRDO-UHFFFAOYSA-N

SMILES:

Nc1ccc(cc1)c1[nH]c2c(n1)cc(c(c2)F)F

Complexity:

294

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

245.076g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

245.233g/mol

Monoisotopic Mass:

245.076g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

54.7A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.8