Products for Research Use Only
RegisterLogin

Quinmerac

CAT: 1596-AR-Q03897-06Size: 250 UnitsDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:1596-AR-Q03897-06Size:250 Units
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
90717-03-6
Molecular Formula
C11H8ClNO2
Molecular Weight
221.64
API Name
Quinmerac

Chemical Information

Quinmerac

Quinmerac is a quinolinemonocarboxylic acid that is quinoline-8-carboxylic acid carrying additional methyl and chloro substituents at positions 3 and 7 respectively. A residual herbicide used to control broad-leaved weeds on a range of crops including cereals, rape and beet. It has a role as a herbicide, a synthetic auxin and an environmental contaminant. It is a quinolinemonocarboxylic acid and an organochlorine compound.

CAS Number90717-03-6
PubChem CID91749
IUPAC Name7-chloro-3-methylquinoline-8-carboxylic acid
Molecular FormulaC11H8ClNO2
Molecular Weight221.64
XLogP2.7
Topological Polar Surface Area50.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Heavy Atom Count15
Formal Charge0
Complexity259
SMILES
CC1=CC2=C(C(=C(C=C2)Cl)C(=O)O)N=C1
InChI
InChI=1S/C11H8ClNO2/c1-6-4-7-2-3-8(12)9(11(14)15)10(7)13-5-6/h2-5H,1H3,(H,14,15)
InChIKey
ALZOLUNSQWINIR-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Quinmerac
CAS: 90717-03-6
CID: 91749
Formula: C11H8ClNO2
MW: 221.64
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight221.64
XLogP32.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Exact Mass221.0243562
Monoisotopic Mass221.0243562
Topological Polar Surface Area50.2 Ų
Heavy Atom Count15
Formal Charge0
Complexity259
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
90717-03-6QUINMERAC
sc-219694Quinmerac-13C6
CS-K-00323Quinmerac metabolite BH 518-4
TRC-Q696510-250MG2-Hydroxy-3-methyl Quinmerac
TRC-Q696505-25MGQuinmerac-3,8-dicarboxylic Acid (>90%)

Popular Products