Name: Name:2-(3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-2-yl)acetic acid
Brand: Angene
SKU: AG01DWWP
Rating: 90 (10 reviews)

2-(3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-2-yl)acetic acid

CAS No.:

95209-82-8

Catalog Number:

AG01DWWP

Molecular Formula:

C5H5N3O4

Molecular Weight:

171.1109

Catalog Number:

AG01DWWP

Chemical Name:

2-(3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-2-yl)acetic acid

CAS Number:

95209-82-8

Molecular Formula:

C5H5N3O4

Molecular Weight:

171.1109

MDL Number:

MFCD20642458

IUPAC Name:

2-(3,5-dioxo-1,2,4-triazin-2-yl)acetic acid

InChI:

InChI=1S/C5H5N3O4/c9-3-1-6-8(2-4(10)11)5(12)7-3/h1H,2H2,(H,10,11)(H,7,9,12)

InChI Key:

XBWHZWHVKVKGDT-UHFFFAOYSA-N

SMILES:

OC(=O)Cn1ncc(=O)[nH]c1=O

Complexity:

272

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

171.028g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

171.112g/mol

Monoisotopic Mass:

171.028g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

99.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

-1.1