Name: Name:3-Quinolinecarboxylic acid, 8-bromo-, hydrate (1:1)
Brand: Angene
SKU: AG001QXQ
Rating: 90 (10 reviews)

3-Quinolinecarboxylic acid, 8-bromo-, hydrate (1:1)

CAS No.:

1588441-16-0

Catalog Number:

AG001QXQ

Molecular Formula:

C10H8BrNO3

Molecular Weight:

270.0794

Catalog Number:

AG001QXQ

Chemical Name:

3-Quinolinecarboxylic acid, 8-bromo-, hydrate (1:1)

CAS Number:

1588441-16-0

Molecular Formula:

C10H8BrNO3

Molecular Weight:

270.0794

MDL Number:

MFCD26743664

IUPAC Name:

8-bromoquinoline-3-carboxylic acid;hydrate

InChI:

InChI=1S/C10H6BrNO2.H2O/c11-8-3-1-2-6-4-7(10(13)14)5-12-9(6)8;/h1-5H,(H,13,14);1H2

InChI Key:

BPHSKRGVFUAODQ-UHFFFAOYSA-N

SMILES:

OC(=O)c1cnc2c(c1)cccc2Br.O

Complexity:

234

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

268.969g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

270.082g/mol

Monoisotopic Mass:

268.969g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

51.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count: