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6574-99-8,MFCD00016379
Catalog No.:AA003IDC
6574-99-8 | 3,4-Dichlorobenzonitrile
Pack Size
Purity
Availability
Price(USD)
Quantity
  
5g
98%
in stock  
$15.00   $10.00
- +
25g
98%
in stock  
$22.00   $15.00
- +
100g
98%
in stock  
$58.00   $40.00
- +
500g
98%
in stock  
$215.00   $150.00
- +
  • Technical Information
  • Properties
  • Literature
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  • Q & A
  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA003IDC
Chemical Name:
3,4-Dichlorobenzonitrile
CAS Number:
6574-99-8
Molecular Formula:
C7H3Cl2N
Molecular Weight:
172.0114
MDL Number:
MFCD00016379
IUPAC Name:
3,4-dichlorobenzonitrile
InChI:
InChI=1S/C7H3Cl2N/c8-6-2-1-5(4-10)3-7(6)9/h1-3H
InChI Key:
KUWBYWUSERRVQP-UHFFFAOYSA-N
SMILES:
N#Cc1ccc(c(c1)Cl)Cl
EC Number:
229-494-8
Properties
Computed Properties
 
Complexity:
160  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
170.964g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
172.008g/mol
Monoisotopic Mass:
170.964g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  

Synonyms
 
3,4-Dichlorobenzonitrile 
6574-99-8 
3,4-Dichloro-Benzonitrile 
EINECS 229-494-8 
PubChem3688 
AC1Q3MWW 
ACMC-1B9LY 
EC 229-494-8 
AC1L30IC 
SCHEMBL825866 
CTK2F8672 
KS-00000EGJ 
Benzonitrile, 3,4-dichloro- 
DTXSID90215944 
BUTTPARK 87\02-72 
OTAVA-BB 1506139 
ZINC152914 
ACN-S004513 
ACT07869 
STR01990 
ANW-35084 
SBB058997 
AKOS001060496 
3,4-dichloro benzonitrile 
AS02652 
CS-W008272 
MCULE-5327391238 
PS-3373 
RP23414 
RTR-037416 
TRA0034427 
AC-15864 
AJ-12843 
AK-94026 
3.4-Dichlorobenzonitrile 
CJ-01200 
SY013672 
ZB005283 
AB0008363 
DB-024198 
TR-037416 
D3415 
FT-0614232 
ST24041139 
ST50406877 
MFCD00016379 
A19027 
MFCD00016379 (97+%) 
574D998 
W-104789 
C7H3Cl2N 
C7-H3-Cl2-N 
CID81051 
AR-1E9080 
ZINC00152914 
3,4-Dichlorobenzonitrile, 99% - 25G 25g 
3, 4-dichlorobenzonitrile 
M-2780 
(5R,5aR,8aR,9S)-5,8,8a,9-Tetrahydro-9-hydroxy-5-(4-hydroxy-3,5-dimethoxyphenyl)-furo[3',4':6,7]naphtho[2,3-d]-1,3-dioxol-6(5aH)-one 
67939-06-4 
3,4-Dichlorobenzonitrile, 97% 
KUWBYWUSERRVQP-UHFFFAOYSA-N 
3,4-dichlorobenzenecarbonitrile 
Literature
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