CAS 2050-99-9 | 5-Nonanone, 2,8-dimethyl- | CAS Number 2050-99-9

200,000+ products from a single source!

sales@angenechem.com

Product Categories

Home > Other Building Blocks > 2050-99-9

2050-99-9 | 5-Nonanone, 2,8-dimethyl-

CAS No: 2050-99-9 Catalog No: AG0029TT MDL No:MFCD00015055

Product Description

Catalog Number:

AG0029TT

Chemical Name:

5-Nonanone, 2,8-dimethyl-

CAS Number:

2050-99-9

Molecular Formula:

C11H22O

Molecular Weight:

170.2918

MDL Number:

MFCD00015055

IUPAC Name:

2,8-dimethylnonan-5-one

InChI:

InChI=1S/C11H22O/c1-9(2)5-7-11(12)8-6-10(3)4/h9-10H,5-8H2,1-4H3

InChI Key:

JQCWLRHNAHIIGW-UHFFFAOYSA-N

SMILES:

CC(CCC(=O)CCC(C)C)C

EC Number:

218-110-4

UNII:

DDP5663XVR

Properties

Complexity:

111

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

170.167g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

170.296g/mol

Monoisotopic Mass:

170.167g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

17.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.2

Literature

Title	Journal
Ru (III) catalyzed oxidation of aliphatic ketones by N-bromosuccinimide in aqueous acetic acid: a kinetic study.	TheScientificWorldJournal 20120101
OSW saponins: facile synthesis toward a new type of structures with potent antitumor activities.	The Journal of organic chemistry 20051209