Home Fluorides 66684-58-0
66684-58-0,MFCD00456803
Catalog No.:AA003IC0
66684-58-0 | 1,2,3-Trifluoro-5-nitrobenzene
Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
98%
in stock  
$12.00   $8.00
- +
5g
97%
in stock  
$36.00   $25.00
- +
25g
97%
in stock  
$86.00   $60.00
- +
100g
97%
in stock  
$279.00   $195.00
- +
  • Technical Information
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  • Technical Information
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Technical Information
Catalog Number:
AA003IC0
Chemical Name:
1,2,3-Trifluoro-5-nitrobenzene
CAS Number:
66684-58-0
Molecular Formula:
C6H2F3NO2
Molecular Weight:
177.0808
MDL Number:
MFCD00456803
IUPAC Name:
1,2,3-trifluoro-5-nitrobenzene
InChI:
InChI=1S/C6H2F3NO2/c7-4-1-3(10(11)12)2-5(8)6(4)9/h1-2H
InChI Key:
PTTUMBGORBMNBN-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cc(F)c(c(c1)F)F
EC Number:
266-447-0
Properties
Computed Properties
 
Complexity:
172  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.004g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
177.082g/mol
Monoisotopic Mass:
177.004g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  

Synonyms
 
3,4,5-Trifluoronitrobenzene 
1,2,3-Trifluoro-5-nitrobenzene 
ACMC-1BAEJ 
AC1Q1XCU 
AC1MD33P 
3,4,5-trifluronitrobenzene 
KSC495S3N 
SCHEMBL239666 
3,4,5-trifluoronitro benzene 
CTK3J5936 
KS-00000ENO 
5-Nitro-1,2,3-trifluorobenzene 
66684-58-0 
PTTUMBGORBMNBN-UHFFFAOYSA-N 
ACT00260 
CS-D1418 
ZINC2565581 
3,4,5-Trifluoronitrobenzene, 97% 
ANW-35235 
CX1181 
SBB063657 
AKOS009158967 
AC-7250 
1-Nitro-3,4,5-trifluorobenzene 
AN-5975 
AS01588 
LS11361 
MCULE-1968943074 
RTC-030627 
TF10532 
TRA0070517 
VF10001 
AJ-41135 
AK-72954 
3,4,5-trifluoro-nitrobenzene 
AS-12424 
BR-72954 
CJ-09711 
SC-06178 
SY005361 
AB0011909 
AB1005386 
DB-006270 
ST2408417 
TC-030627 
1,2,3-trifluoro-5-nitro-benzene 
TL8004716 
4CH-013239 
A1766 
AM20050548 
FT-0085008 
FT-0641089 
ST50408524 
EN300-45047 
MFCD00456803 (98%) 
M-2674 
MFCD00456803 
I01-2423 
1-Nitro-3,4,5-trifluorobenzene; 3,4,5-Trifluoronitrobenzene 
C6H2F3NO2 
C6-H2-F3-N-O2 
ZINC02565581 
ACN-056084 
CID2782793 
T2357 
3,4,5-Trifluoronitrobenzene, 98.5% - 1G 1g 
Benzene, 1,2,3-trifluoro-5-nitro- 
EINECS 266-447-0 
PubChem1071 
Literature
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