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Home Other Building Blocks 2-Fluoro-4-methylaniline

2-Fluoro-4-methylaniline

CAS No.:
452-80-2
Catalog Number:
AG0033B4
Molecular Formula:
C7H8FN
Molecular Weight:
125.1435
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
95%
In Stock USA
United States
$13
- +
10g
95%
In Stock USA
United States
$23
- +
25g
95%
In Stock USA
United States
$32
- +
100g
98%
In Stock USA
United States
$100
- +
Product Description
Catalog Number:
AG0033B4
Chemical Name:
2-Fluoro-4-methylaniline
CAS Number:
452-80-2
Molecular Formula:
C7H8FN
Molecular Weight:
125.1435
MDL Number:
MFCD00040975
IUPAC Name:
2-fluoro-4-methylaniline
InChI:
InChI=1S/C7H8FN/c1-5-2-3-7(9)6(8)4-5/h2-4H,9H2,1H3
InChI Key:
ZQEXBVHABAJPHJ-UHFFFAOYSA-N
SMILES:
Cc1ccc(c(c1)F)N
NSC Number:
147489
Properties
Complexity:
94.9  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
125.064g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
125.146g/mol
Monoisotopic Mass:
125.064g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Literature
Title Journal
Metabolic changes reveal the development of schistosomiasis in mice. PLoS neglected tropical diseases 20100801
'Systems toxicology' approach identifies coordinated metabolic responses to copper in a terrestrial non-model invertebrate, the earthworm Lumbricus rubellus. BMC biology 20080101
Metabonomic assessment of toxicity of 4-fluoroaniline, 3,5-difluoroaniline and 2-fluoro-4-methylaniline to the earthworm Eisenia veneta (Rosa): identification of new endogenous biomarkers. Environmental toxicology and chemistry 20020901
A highly effective nonpolar isostere of deoxyguanosine: synthesis, structure, stacking, and base pairing. The Journal of organic chemistry 20020823
Properties