CAS 619-24-9 | Benzonitrile, 3-nitro- | CAS Number 619-24-9

200,000+ products from a single source!

sales@angenechem.com

Product Categories

Home > Nitro Compounds > 619-24-9

619-24-9 | Benzonitrile, 3-nitro-

CAS No: 619-24-9 Catalog No: AG00IKFU MDL No:MFCD00007194

Product Description

Catalog Number:

AG00IKFU

Chemical Name:

Benzonitrile, 3-nitro-

CAS Number:

619-24-9

Molecular Formula:

C7H4N2O2

Molecular Weight:

148.1189

MDL Number:

MFCD00007194

IUPAC Name:

3-nitrobenzonitrile

InChI:

InChI=1S/C7H4N2O2/c8-5-6-2-1-3-7(4-6)9(10)11/h1-4H

InChI Key:

RUSAWEHOGCWOPG-UHFFFAOYSA-N

SMILES:

N#Cc1cccc(c1)[N+](=O)[O-]

EC Number:

210-587-7

NSC Number:

5382

RTECS Number:

DI4900000

Properties

Complexity:

200

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

148.027g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

148.121g/mol

Monoisotopic Mass:

148.027g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

69.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.2

Literature

Title	Journal
Electrospray ionization mass spectrometry: a technique to access the information beyond the molecular weight of the analyte.	International journal of analytical chemistry 20120101
New reagents for increasing ESI multiple charging of proteins and protein complexes.	Journal of the American Society for Mass Spectrometry 20100101
DNA display III. Solid-phase organic synthesis on unprotected DNA.	PLoS biology 20040701