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Home Halogens 3,5-Diaminobenzotrifluoride

3,5-Diaminobenzotrifluoride

CAS No.:
368-53-6
Catalog Number:
AG003IKP
Molecular Formula:
C7H7F3N2
Molecular Weight:
176.1391
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$19
- +
5g
95%
In Stock USA
United States
$50
- +
25g
95%
In Stock USA
United States
$188
- +
100g
95%
In Stock USA
United States
$525
- +
Product Description
Catalog Number:
AG003IKP
Chemical Name:
3,5-Diaminobenzotrifluoride
CAS Number:
368-53-6
Molecular Formula:
C7H7F3N2
Molecular Weight:
176.1391
MDL Number:
MFCD00014776
IUPAC Name:
5-(trifluoromethyl)benzene-1,3-diamine
InChI:
InChI=1S/C7H7F3N2/c8-7(9,10)4-1-5(11)3-6(12)2-4/h1-3H,11-12H2
InChI Key:
KZSXRDLXTFEHJM-UHFFFAOYSA-N
SMILES:
FC(c1cc(N)cc(c1)N)(F)F
EC Number:
206-708-8
UNII:
Z89RD529KK
Properties
Complexity:
147  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
176.056g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
176.142g/mol
Monoisotopic Mass:
176.056g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
52A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Literature
Title Journal
Photochemical reactivity of trifluoromethyl aromatic amines: the example of 3,5-diamino-trifluoromethyl-benzene (3,5-DABTF). Photochemistry and photobiology 20050101
Properties