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Home Other Building Blocks 2,5-Dimethylindole

2,5-Dimethylindole

CAS No.:
1196-79-8
Catalog Number:
AG000P96
Molecular Formula:
C10H11N
Molecular Weight:
145.2010
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$13
- +
5g
97%
In Stock USA
United States
$32
- +
25g
97%
In Stock USA
United States
$119
- +
100g
97%
In Stock USA
United States
$350
- +
Product Description
Catalog Number:
AG000P96
Chemical Name:
2,5-Dimethylindole
CAS Number:
1196-79-8
Molecular Formula:
C10H11N
Molecular Weight:
145.2010
MDL Number:
MFCD00005621
IUPAC Name:
2,5-dimethyl-1H-indole
InChI:
InChI=1S/C10H11N/c1-7-3-4-10-9(5-7)6-8(2)11-10/h3-6,11H,1-2H3
InChI Key:
ZFLFWZRPMDXJCW-UHFFFAOYSA-N
SMILES:
Cc1ccc2c(c1)cc([nH]2)C
EC Number:
214-816-1
UNII:
ETU94V283M
Properties
Complexity:
144  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
145.089g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
145.205g/mol
Monoisotopic Mass:
145.089g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
15.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Literature
Title Journal
Indole ring oxidation by activated leukocytes prevents the production of hypochlorous acid. Brazilian journal of medical and biological research = Revista brasileira de pesquisas medicas e biologicas 20051101
Prediction of genotoxicity of chemical compounds by statistical learning methods. Chemical research in toxicology 20050601
Properties