Benzonitrile, 2,5-dichloro-


Chemical Name: Benzonitrile, 2,5-dichloro-
CAS Number: 21663-61-6
Product Number: AG003FXC(AGN-PC-0JLXSK)
Synonyms:
MDL No: MFCD00019741
Molecular Formula: C7H3Cl2N
Molecular Weight: 172.0114

Identification/Properties


Properties
MP:
128-132 °C(lit.)
BP:
247.6°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
172.008g/mol
XLogP3:
2.6
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
0
Exact Mass:
170.964g/mol
Monoisotopic Mass:
170.964g/mol
Topological Polar Surface Area:
23.8A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
160
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-H319-H332-H335
Precautionary Statements:
P261-P280-P301+P312-P305+P351+P338
Class:
6.1
Packing Group:

NMR Spectrum


Other Analytical Data


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