2-Thiophenecarbonyl chloride, 3-chloro-


Chemical Name: 2-Thiophenecarbonyl chloride, 3-chloro-
CAS Number: 86427-02-3
Product Number: AG004NLM(AGN-PC-0KK7DJ)
Synonyms:
MDL No:
Molecular Formula: C5H2Cl2OS
Molecular Weight: 181.0398

Identification/Properties


Properties
MP:
45-46 °C
BP:
239.3 °C at 760 mmHg
Storage:
2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
181.03g/mol
XLogP3:
3.1
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
1
Exact Mass:
179.92g/mol
Monoisotopic Mass:
179.92g/mol
Topological Polar Surface Area:
45.3A^2
Heavy Atom Count:
9
Formal Charge:
0
Complexity:
128
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#:
1759
Hazard Statements:
H314
Precautionary Statements:
P260-P264-P280-P301+P330+P331-P303+P361+P353-P304+P340-P305+P351+P338-P310-P321-P363-P405-P501
Class:
8
Packing Group:

NMR Spectrum


Other Analytical Data


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