Name: Name:1-Methyl-1,2,4-triazole 4-nitroimide
Brand: Angene
SKU: AG01EWC3
Rating: 90 (10 reviews)

1-Methyl-1,2,4-triazole 4-nitroimide

CAS No.:

52096-17-0

Catalog Number:

AG01EWC3

Molecular Formula:

C3H5N5O2

Molecular Weight:

143.1041

Catalog Number:

AG01EWC3

Chemical Name:

1-Methyl-1,2,4-triazole 4-nitroimide

CAS Number:

52096-17-0

Molecular Formula:

C3H5N5O2

Molecular Weight:

143.1041

MDL Number:

MFCD06201308

IUPAC Name:

(1-methyl-1,2,4-triazol-4-ium-4-yl)-nitroazanide

InChI:

InChI=1S/C3H5N5O2/c1-6-3-7(2-4-6)5-8(9)10/h2-3H,1H3

InChI Key:

WYDUXYVFWUUSMI-UHFFFAOYSA-N

SMILES:

[O-][N+](=O)[N-][n+]1cnn(c1)C

Complexity:

133

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

143.044g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

143.106g/mol

Monoisotopic Mass:

143.044g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

68.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.7