Name: Name:{[1-(2,2-difluoroethyl)-1H-1,2,4-triazol-5-yl]methyl}(methyl)amine
Brand: Angene
SKU: AG01BFLF
Rating: 90 (10 reviews)

{[1-(2,2-difluoroethyl)-1H-1,2,4-triazol-5-yl]methyl}(methyl)amine

CAS No.:

1497455-41-0

Catalog Number:

AG01BFLF

Molecular Formula:

C6H10F2N4

Molecular Weight:

176.1672

Catalog Number:

AG01BFLF

Chemical Name:

{[1-(2,2-difluoroethyl)-1H-1,2,4-triazol-5-yl]methyl}(methyl)amine

CAS Number:

1497455-41-0

Molecular Formula:

C6H10F2N4

Molecular Weight:

176.1672

MDL Number:

MFCD21272441

IUPAC Name:

1-[2-(2,2-difluoroethyl)-1,2,4-triazol-3-yl]-N-methylmethanamine

InChI:

InChI=1S/C6H10F2N4/c1-9-2-6-10-4-11-12(6)3-5(7)8/h4-5,9H,2-3H2,1H3

InChI Key:

HFDQTPVLHGISJT-UHFFFAOYSA-N

SMILES:

CNCc1ncnn1CC(F)F

Complexity:

133

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

176.087g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

176.171g/mol

Monoisotopic Mass:

176.087g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

42.7A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.2