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Home Halogens N-Methyl 2-bromo-5-(trifluoromethyl)aniline, HCl

N-Methyl 2-bromo-5-(trifluoromethyl)aniline, HCl

CAS No.:
1187386-33-9
Catalog Number:
AG0075K0
Molecular Formula:
C8H8BrClF3N
Molecular Weight:
290.5080
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$150
- +
5g
98%
In Stock USA
United States
$450
- +
25g
98%
In Stock USA
United States
$1225
- +
Product Description
Catalog Number:
AG0075K0
Chemical Name:
N-Methyl 2-bromo-5-(trifluoromethyl)aniline, HCl
CAS Number:
1187386-33-9
Molecular Formula:
C8H8BrClF3N
Molecular Weight:
290.5080
MDL Number:
MFCD12913959
IUPAC Name:
2-bromo-N-methyl-5-(trifluoromethyl)aniline;hydrochloride
InChI:
InChI=1S/C8H7BrF3N.ClH/c1-13-7-4-5(8(10,11)12)2-3-6(7)9;/h2-4,13H,1H3;1H
InChI Key:
ZRYZQFUHSMTCDR-UHFFFAOYSA-N
SMILES:
CNc1cc(ccc1Br)C(F)(F)F.Cl
Properties
Complexity:
171  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
288.948g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
290.508g/mol
Monoisotopic Mass:
288.948g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties