3-Pyridineacetonitrile, 6-chloro-


Chemical Name: 3-Pyridineacetonitrile, 6-chloro-
CAS Number: 39891-09-3
Product Number: AG00338J(AGN-PC-0K5QCA)
Synonyms:
MDL No: MFCD04112495
Molecular Formula: C7H5ClN2
Molecular Weight: 152.5810

Identification/Properties


Properties
MP:
49-54 °C
BP:
294.1°C at 760 mmHg
Storage:
Inert atmosphere;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
152.581g/mol
XLogP3:
1.5
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
1
Exact Mass:
152.014g/mol
Monoisotopic Mass:
152.014g/mol
Topological Polar Surface Area:
36.7A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
149
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Danger
UN#:
3439
Hazard Statements:
H301-H315-H318-H335
Precautionary Statements:
P261-P280-P301+P310-P305+P351+P338
Class:
6.1
Packing Group:

NMR Spectrum


Other Analytical Data


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