Name: Name:2-(4-propiolamido-1H-pyrazol-1-yl)acetic acid
Brand: Angene
SKU: AG01DV1E
Rating: 90 (10 reviews)

2-(4-propiolamido-1H-pyrazol-1-yl)acetic acid

CAS No.:

1178944-49-4

Catalog Number:

AG01DV1E

Molecular Formula:

C8H7N3O3

Molecular Weight:

193.1595

Catalog Number:

AG01DV1E

Chemical Name:

2-(4-propiolamido-1H-pyrazol-1-yl)acetic acid

CAS Number:

1178944-49-4

Molecular Formula:

C8H7N3O3

Molecular Weight:

193.1595

MDL Number:

MFCD12778115

IUPAC Name:

2-[4-(prop-2-ynoylamino)pyrazol-1-yl]acetic acid

InChI:

InChI=1S/C8H7N3O3/c1-2-7(12)10-6-3-9-11(4-6)5-8(13)14/h1,3-4H,5H2,(H,10,12)(H,13,14)

InChI Key:

UBYSFEQWEPLEFK-UHFFFAOYSA-N

SMILES:

C#CC(=O)Nc1cnn(c1)CC(=O)O

Complexity:

294

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

193.049g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

193.162g/mol

Monoisotopic Mass:

193.049g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

84.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

-0.4