Home Pyridines 6443-85-2
6443-85-2,MFCD00006406
Catalog No.:AA003F1N
6443-85-2 | 3-Pyridylacetonitrile
Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
95%
in stock  
$24.00   $17.00
- +
5g
95%
in stock  
$72.00   $50.00
- +
10g
95%
in stock  
$127.00   $89.00
- +
25g
95%
in stock  
$254.00   $178.00
- +
100g
95%
in stock  
$667.00   $467.00
- +
  • Technical Information
  • Properties
  • Literature
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  • Q & A
  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA003F1N
Chemical Name:
3-Pyridylacetonitrile
CAS Number:
6443-85-2
Molecular Formula:
C7H6N2
Molecular Weight:
118.1359
MDL Number:
MFCD00006406
IUPAC Name:
2-pyridin-3-ylacetonitrile
InChI:
InChI=1S/C7H6N2/c8-4-3-7-2-1-5-9-6-7/h1-2,5-6H,3H2
InChI Key:
OIPHWUPMXHQWLR-UHFFFAOYSA-N
SMILES:
N#CCc1cccnc1
EC Number:
229-241-1
NSC Number:
83226
Properties
Computed Properties
 
Complexity:
122  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
118.053g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
118.139g/mol
Monoisotopic Mass:
118.053g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
36.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5  

Synonyms
 
6443-85-2 
3-Pyridylacetonitrile 
3-Pyridylacetonitrile, 98% 
OIPHWUPMXHQWLR-UHFFFAOYSA-N 
2-(3-pyridyl)ethanenitrile 
pyridin-3-yl-acetonitrile 
NSC83226 
EINECS 229-241-1 
NSC 83226 
3-pyridyl acetonitrile 
pyrid-3-ylacetonitrile 
3-Pyridine acetonitrile 
3-Pyridineacetonitrile 
pyrid-3-yl-acetonitrile 
3-Pyridinylacetonitrile # 
AC1L30AD 
AC1Q4S1O 
ACMC-1B43A 
SCHEMBL254758 
AC1Q4S49 
AMPD00252 
CTK2F6827 
OIPHWUPMXHQWLR-UHFFFAOYSA- 
2-(pyridin-3-yl)acetonitrile 
ZINC391916 
ALBB-009272 
KS-00000K6F 
ANW-34875 
NSC-83226 
SBB027148 
STK505791 
AKOS000200426 
CS-W009194 
MCULE-4281335903 
Pyridine-3-acetonitrile 
QC-1840 
RL04459 
RTR-022075 
TRA0025180 
AC-24997 
AJ-21169 
AK-44402 
AS-16040 
CJ-03546 
R947 
3-Cyanomethylpyridine 
SC-21789 
ZB012120 
DB-016022 
ST2416239 
ST4150457 
TR-022075 
AM20061403 
BB 0254178 
FT-0636152 
P1232 
3-(Cyanomethyl)pyridine 
EN300-27473 
M-5567 
443P852 
W-104839 
I14-30236 
InChI=1/C7H6N2/c8-4-3-7-2-1-5-9-6-7/h1-2,5-6H,3H2 
C7H6N2 
C7-H6-N2 
CID80923 
AR-1F2823 
pyridin-3-ylacetonitrile 
ACN-028353 
3-Pyridylacetonitrile, 98% - 1G 1g 
6628-13-3 
MFCD00006406 
2-pyridin-3-ylacetonitrile 
Literature

Title: catena-Poly[[(3-methyl-pyridine)-copper(I)]-μ-cyanido-copper(I)-μ-cyanido].

Journal: Acta crystallographica. Section E, Structure reports online 20110801

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