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Home Other Building Blocks 4-Iodo-2-methylaniline

4-Iodo-2-methylaniline

CAS No.:
13194-68-8
Catalog Number:
AG000ZYG
Molecular Formula:
C7H8IN
Molecular Weight:
233.0496
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
98%
In Stock USA
United States
$13
- +
25g
98%
In Stock USA
United States
$57
- +
100g
98%
In Stock USA
United States
$150
- +
500g
98%
In Stock USA
United States
$563
- +
Product Description
Catalog Number:
AG000ZYG
Chemical Name:
4-Iodo-2-methylaniline
CAS Number:
13194-68-8
Molecular Formula:
C7H8IN
Molecular Weight:
233.0496
MDL Number:
MFCD00025299
IUPAC Name:
4-iodo-2-methylaniline
InChI:
InChI=1S/C7H8IN/c1-5-4-6(8)2-3-7(5)9/h2-4H,9H2,1H3
InChI Key:
BGKLFAQCHHCZRZ-UHFFFAOYSA-N
SMILES:
Ic1ccc(c(c1)C)N
EC Number:
236-154-2
NSC Number:
60731
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:
232.97g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
233.052g/mol
Monoisotopic Mass:
232.97g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Literature
Title Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
4-Iodo-2-methyl-aniline. Acta crystallographica. Section E, Structure reports online 20080301
Properties