Name: Name:4-[(prop-2-en-1-yl)amino]cinnoline-3-carboxylic acid
Brand: Angene
SKU: AG01A5PY
Rating: 90 (10 reviews)

4-[(prop-2-en-1-yl)amino]cinnoline-3-carboxylic acid

CAS No.:

1443980-57-1

Catalog Number:

AG01A5PY

Molecular Formula:

C12H11N3O2

Molecular Weight:

229.2346

Catalog Number:

AG01A5PY

Chemical Name:

4-[(prop-2-en-1-yl)amino]cinnoline-3-carboxylic acid

CAS Number:

1443980-57-1

Molecular Formula:

C12H11N3O2

Molecular Weight:

229.2346

MDL Number:

MFCD20091017

IUPAC Name:

4-(prop-2-enylamino)cinnoline-3-carboxylic acid

InChI:

InChI=1S/C12H11N3O2/c1-2-7-13-10-8-5-3-4-6-9(8)14-15-11(10)12(16)17/h2-6H,1,7H2,(H,13,14)(H,16,17)

InChI Key:

OQLKKGNBJRMQSZ-UHFFFAOYSA-N

SMILES:

C=CCNc1c(nnc2c1cccc2)C(=O)O

Complexity:

296

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

229.085g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

229.239g/mol

Monoisotopic Mass:

229.085g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

75.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.2