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5367-26-0,MFCD04117977
Catalog No.:AA003HP8
5367-26-0 | 3-Chloro-2-nitrotoluene
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Purity
Availability
Price(USD)
Quantity
  
1g
98+%
in stock  
$7.00   $5.00
- +
5g
98+%
in stock  
$18.00   $12.00
- +
25g
98+%
in stock  
$55.00   $39.00
- +
  • Technical Information
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  • Technical Information
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Technical Information
Catalog Number:
AA003HP8
Chemical Name:
3-Chloro-2-nitrotoluene
CAS Number:
5367-26-0
Molecular Formula:
C7H6ClNO2
Molecular Weight:
171.5810
MDL Number:
MFCD04117977
IUPAC Name:
1-chloro-3-methyl-2-nitrobenzene
InChI:
InChI=1S/C7H6ClNO2/c1-5-3-2-4-6(8)7(5)9(10)11/h2-4H,1H3
InChI Key:
JLDKNVUJLUGIBQ-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1c(C)cccc1Cl
EC Number:
226-354-8
Properties
Computed Properties
 
Complexity:
157  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
171.009g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
171.58g/mol
Monoisotopic Mass:
171.009g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  

Synonyms
 
3-Chloro-2-nitrotoluene 
5367-26-0 
AC1L2X5M 
SCHEMBL541489 
CTK3J4070 
KS-00000ENU 
DTXSID20201911 
JLDKNVUJLUGIBQ-UHFFFAOYSA-N 
6-methyl-2-chloro-1-nitrobenzene 
1-chloro-3-methyl-2-nitro-benzene 
ACN-S004471 
ACT04607 
1-chloro-3-methyl-2-nitrobenzene 
CS-D1523 
ZINC2529222 
ANW-51460 
MFCD04117977 
AKOS006292142 
AC-4787 
AM62637 
CM13947 
RP23378 
RTR-018988 
2-NITRO-3-CHLOROTOLUENE 
TRA0004464 
AJ-38411 
AK-26088 
AN-11608 
BR-26088 
CJ-09065 
DS-10708 
SC-05153 
SY006114 
AB0006749 
Benzene, 1-chloro-3-methyl-2-nitro- 
DB-006395 
ST2417622 
TR-018988 
FT-0601386 
W6803 
S-3352 
MFCD04117977 (97+%) 
367C260 
I01-1769 
J-512207 
chlornitrotoluole 
C7H6ClNO2 
C7-H6-Cl-N-O2 
CID79328 
AR-1C2355 
ZINC02529222 
C2731 
54546-22-4 
EINECS 226-354-8 
PubChem2090 
AC1Q5ADD 
2-Nitro-3-chloro toluene 
Literature
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