Home Other Building Blocks 2,4-Dimethylheptane

2,4-Dimethylheptane

CAS No.:
2213-23-2
Catalog Number:
AG003FUH
Molecular Formula:
C9H20
Molecular Weight:
128.2551
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
In Stock USA
United States
$105
- +
1g
95%
In Stock USA
United States
$335
- +
Product Description
Catalog Number:
AG003FUH
Chemical Name:
2,4-Dimethylheptane
CAS Number:
2213-23-2
Molecular Formula:
C9H20
Molecular Weight:
128.2551
MDL Number:
MFCD00048738
IUPAC Name:
2,4-dimethylheptane
InChI:
InChI=1S/C9H20/c1-5-6-9(4)7-8(2)3/h8-9H,5-7H2,1-4H3
InChI Key:
AUKVIBNBLXQNIZ-UHFFFAOYSA-N
SMILES:
CCCC(CC(C)C)C
Properties
Complexity:
55.1  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
128.157g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
128.259g/mol
Monoisotopic Mass:
128.157g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5  
Literature
Title Journal
Analysis of volatile organic compounds released from human lung cancer cells and from the urine of tumor-bearing mice. Cancer cell international 20120101
Quantification of hexanal as an index of lipid oxidation in human milk and association with antioxidant components. Journal of clinical biochemistry and nutrition 20111101
Authentication of fattening diet of Iberian pigs according to their volatile compounds profile from raw subcutaneous fat. Analytical and bioanalytical chemistry 20110201
Advances in electronic-nose technologies developed for biomedical applications. Sensors (Basel, Switzerland) 20110101
Approach to estimation of absorption of aliphatic hydrocarbons diffusing from interior materials in an automobile cabin by inhalation toxicokinetic analysis in rats. Journal of applied toxicology : JAT 20100101
The analysis of healthy volunteers' exhaled breath by the use of solid-phase microextraction and GC-MS. Journal of breath research 20081201
Release of volatile organic compounds (VOCs) from the lung cancer cell line CALU-1 in vitro. Cancer cell international 20080101
Properties