Name: Name:2,2-difluoro-2-(3-methyl-1H-1,2,4-triazol-5-yl)ethan-1-amine
Brand: Angene
SKU: AG01AL9U
Rating: 90 (10 reviews)

2,2-difluoro-2-(3-methyl-1H-1,2,4-triazol-5-yl)ethan-1-amine

CAS No.:

1803608-53-8

Catalog Number:

AG01AL9U

Molecular Formula:

C5H8F2N4

Molecular Weight:

162.1406

Catalog Number:

AG01AL9U

Chemical Name:

2,2-difluoro-2-(3-methyl-1H-1,2,4-triazol-5-yl)ethan-1-amine

CAS Number:

1803608-53-8

Molecular Formula:

C5H8F2N4

Molecular Weight:

162.1406

MDL Number:

MFCD28954298

IUPAC Name:

2,2-difluoro-2-(5-methyl-1H-1,2,4-triazol-3-yl)ethanamine

InChI:

InChI=1S/C5H8F2N4/c1-3-9-4(11-10-3)5(6,7)2-8/h2,8H2,1H3,(H,9,10,11)

InChI Key:

BWWZXCGQOMWURJ-UHFFFAOYSA-N

SMILES:

NCC(c1[nH]nc(n1)C)(F)F

Complexity:

140

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

162.072g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

162.144g/mol

Monoisotopic Mass:

162.072g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

67.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

-0.1