Name: Name:ethyl 2-[4-methyl-5-(methylamino)-4H-1,2,4-triazol-3-yl]acetate
Brand: Angene
SKU: AG01B7BO
Rating: 90 (10 reviews)

ethyl 2-[4-methyl-5-(methylamino)-4H-1,2,4-triazol-3-yl]acetate

CAS No.:

1567078-48-1

Catalog Number:

AG01B7BO

Molecular Formula:

C8H14N4O2

Molecular Weight:

198.2224

Catalog Number:

AG01B7BO

Chemical Name:

ethyl 2-[4-methyl-5-(methylamino)-4H-1,2,4-triazol-3-yl]acetate

CAS Number:

1567078-48-1

Molecular Formula:

C8H14N4O2

Molecular Weight:

198.2224

MDL Number:

MFCD26052668

IUPAC Name:

ethyl 2-[4-methyl-5-(methylamino)-1,2,4-triazol-3-yl]acetate

InChI:

InChI=1S/C8H14N4O2/c1-4-14-7(13)5-6-10-11-8(9-2)12(6)3/h4-5H2,1-3H3,(H,9,11)

InChI Key:

RMYHUDOJGRBHHT-UHFFFAOYSA-N

SMILES:

CCOC(=O)Cc1nnc(n1C)NC

Complexity:

200

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

198.112g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

198.226g/mol

Monoisotopic Mass:

198.112g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

69A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

-0.1