CAS 113486-29-6 | 2,4-Nonanedione, 3-methyl- | CAS Number 113486-29-6

200,000+ products from a single source!

sales@angenechem.com

Product Categories

Home > Other Building Blocks > 113486-29-6

113486-29-6 | 2,4-Nonanedione, 3-methyl-

CAS No: 113486-29-6 Catalog No: AG0008R8 MDL No:MFCD08741451

Product Description

Catalog Number:

AG0008R8

Chemical Name:

2,4-Nonanedione, 3-methyl-

CAS Number:

113486-29-6

Molecular Formula:

C10H18O2

Molecular Weight:

170.2487

MDL Number:

MFCD08741451

IUPAC Name:

3-methylnonane-2,4-dione

InChI:

InChI=1S/C10H18O2/c1-4-5-6-7-10(12)8(2)9(3)11/h8H,4-7H2,1-3H3

InChI Key:

BGVBGAIWXAXBLP-UHFFFAOYSA-N

SMILES:

CCCCCC(=O)C(C(=O)C)C

EC Number:

601-256-1

FEMA Number:

4057

Properties

Complexity:

161

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

170.131g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

170.252g/mol

Monoisotopic Mass:

170.131g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

34.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.3

Literature

Title	Journal
Determination of 3-methyl-2,4-nonanedione in red wines using methanol chemical ionization ion trap mass spectrometry.	Journal of chromatography. A 20110928
Identification of volatile compounds responsible for prune aroma in prematurely aged red wines.	Journal of agricultural and food chemistry 20080709
New constituents related to 3-methyl-2,4-nonanedione identified in green tea.	Journal of agricultural and food chemistry 20061129
Freshness assessments of Moroccan sardine (Sardina pilchardus): comparison of overall sensory changes to instrumentally determined volatiles.	Journal of agricultural and food chemistry 20031217
Aroma compounds formed from 3-methyl-2,4-nonanedione under photooxidative conditions.	Journal of agricultural and food chemistry 20030521
Identification of potent odorants in different green tea varieties using flavor dilution technique.	Journal of agricultural and food chemistry 20020925
Practical synthesis of 3-methylnonane-2,4-dione, an intense strawlike and fruity flavored compound.	Journal of agricultural and food chemistry 20010801