Name: Name:2-[5-amino-2-(trifluoromethyl)-1H-1,3-benzodiazol-1-yl]propan-1-ol
Brand: Angene
SKU: AG01AUBE
Rating: 90 (10 reviews)

2-[5-amino-2-(trifluoromethyl)-1H-1,3-benzodiazol-1-yl]propan-1-ol

CAS No.:

1495306-49-4

Catalog Number:

AG01AUBE

Molecular Formula:

C11H12F3N3O

Molecular Weight:

259.2277

Catalog Number:

AG01AUBE

Chemical Name:

2-[5-amino-2-(trifluoromethyl)-1H-1,3-benzodiazol-1-yl]propan-1-ol

CAS Number:

1495306-49-4

Molecular Formula:

C11H12F3N3O

Molecular Weight:

259.2277

MDL Number:

MFCD18938430

IUPAC Name:

2-[5-amino-2-(trifluoromethyl)benzimidazol-1-yl]propan-1-ol

InChI:

InChI=1S/C11H12F3N3O/c1-6(5-18)17-9-3-2-7(15)4-8(9)16-10(17)11(12,13)14/h2-4,6,18H,5,15H2,1H3

InChI Key:

PLXFUFORZHRCBB-UHFFFAOYSA-N

SMILES:

OCC(n1c2ccc(cc2nc1C(F)(F)F)N)C

Complexity:

300

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

259.093g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

259.232g/mol

Monoisotopic Mass:

259.093g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

64.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.3