1H-Benzimidazole, 2-(chloromethyl)-


Chemical Name: 1H-Benzimidazole, 2-(chloromethyl)-
CAS Number: 4857-04-9
Product Number: AG003H2N(AGN-PC-0JLRGE)
Synonyms:
MDL No:
Molecular Formula: C8H7ClN2
Molecular Weight: 166.6076

Identification/Properties


Properties
MP:
146-148 °C
BP:
274.83°C (rough estimate)
Storage:
Inert atmosphere;2-8℃;
Form:
Solid
Refractive Index:
1.5500 (estimate)
Computed Properties
Molecular Weight:
166.608g/mol
XLogP3:
2.2
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
1
Exact Mass:
166.03g/mol
Monoisotopic Mass:
166.03g/mol
Topological Polar Surface Area:
28.7A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
140
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:
Warning
UN#:
N/A
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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