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368-77-4,MFCD00001807
Catalog No.:AA003I7Z

368-77-4 | 3-(Trifluoromethyl)benzonitrile

Pack Size
Purity
Availability
Price(USD)
Quantity
  
5g
98%
in stock  
$9.00   $7.00
- +
10g
98%
in stock  
$12.00   $8.00
- +
25g
98%
in stock  
$16.00   $11.00
- +
100g
98%
in stock  
$51.00   $36.00
- +
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA003I7Z
Chemical Name:
3-(Trifluoromethyl)benzonitrile
CAS Number:
368-77-4
Molecular Formula:
C8H4F3N
Molecular Weight:
171.1193
MDL Number:
MFCD00001807
SMILES:
N#Cc1cccc(c1)C(F)(F)F
NSC Number:
88314
Properties
Properties
 
BP:
189°C at 760 mmHg  
Form:
Liquid  
MP:
16-20 °C(lit.)  
Refractive Index:
n20/D 1.4575(lit.)  
Stability:
Lachrymatory  
Storage:
Keep in dry area;Room Temperature;  

Computed Properties
 
Complexity:
200  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0  
Isotope Atom Count:
0  
Rotatable Bond Count:
0  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
3  

Literature

Title: Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.

Journal: Bioorganic & medicinal chemistry letters 20101101

Title: Direct quantitative determination of cyanamide by stable isotope dilution gas chromatography-mass spectrometry.

Journal: Journal of chromatography. A 20051209

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Tags:368-77-4 Molecular Formula|368-77-4 MDL|368-77-4 SMILES|368-77-4 3-(Trifluoromethyl)benzonitrile
Catalog No.: AA003I7Z
368-77-4,MFCD00001807
368-77-4 | 3-(Trifluoromethyl)benzonitrile
Pack Size： 5g
Purity： 98%
in stock
$9.00 $7.00
Pack Size： 10g
Purity： 98%
in stock
$12.00 $8.00
Pack Size： 25g
Purity： 98%
in stock
$16.00 $11.00
Pack Size： 100g
Purity： 98%
in stock
$51.00 $36.00
Quantity
- +
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Technical Information
Catalog Number: AA003I7Z
Chemical Name: 3-(Trifluoromethyl)benzonitrile
CAS Number: 368-77-4
Molecular Formula: C8H4F3N
Molecular Weight: 171.1193
MDL Number: MFCD00001807
SMILES: N#Cc1cccc(c1)C(F)(F)F
NSC Number: 88314
Properties
BP: 189°C at 760 mmHg  
Form: Liquid  
MP: 16-20 °C(lit.)  
Refractive Index: n20/D 1.4575(lit.)  
Stability: Lachrymatory  
Storage: Keep in dry area;Room Temperature;  
Complexity: 200  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 12  
Hydrogen Bond Acceptor Count: 4  
Hydrogen Bond Donor Count: 0  
Isotope Atom Count: 0  
Rotatable Bond Count: 0  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 3  
Literature fold

Title: Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.

Journal: Bioorganic & medicinal chemistry letters20101101

Title: Direct quantitative determination of cyanamide by stable isotope dilution gas chromatography-mass spectrometry.

Journal: Journal of chromatography. A20051209

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