Name: Name:2-(6-CHLOROPYRIDAZIN-3-YL)-2-(4-METHYLPHENYL)ACETONITRILE
Brand: Angene
SKU: AG003EYG
Rating: 90 (10 reviews)

2-(6-CHLOROPYRIDAZIN-3-YL)-2-(4-METHYLPHENYL)ACETONITRILE

CAS No.:

339008-32-1

Catalog Number:

AG003EYG

Molecular Formula:

C13H10ClN3

Molecular Weight:

243.6916

Pack Size

Purity

Availability

Location

Price(USD)

Quantity

Product Description

Catalog Number:

AG003EYG

Chemical Name:

2-(6-CHLOROPYRIDAZIN-3-YL)-2-(4-METHYLPHENYL)ACETONITRILE

CAS Number:

339008-32-1

Molecular Formula:

C13H10ClN3

Molecular Weight:

243.6916

MDL Number:

MFCD00214777

IUPAC Name:

2-(6-chloropyridazin-3-yl)-2-(4-methylphenyl)acetonitrile

InChI:

InChI=1S/C13H10ClN3/c1-9-2-4-10(5-3-9)11(8-15)12-6-7-13(14)17-16-12/h2-7,11H,1H3

InChI Key:

BSXPVUKZVCIWHG-UHFFFAOYSA-N

SMILES:

N#CC(c1ccc(nn1)Cl)c1ccc(cc1)C

Properties

Complexity:

290

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

243.056g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

243.694g/mol

Monoisotopic Mass:

243.056g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

49.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.6

Literature

Title	Journal
Microsphere-based protease assays and screening application for lethal factor and factor Xa.	Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501

Properties