Benzo[b]thiophene-2-carbonyl chloride, 3-chloro-


Chemical Name: Benzo[b]thiophene-2-carbonyl chloride, 3-chloro-
CAS Number: 21815-91-8
Product Number: AG003JAE(AGN-PC-0JS95K)
Synonyms:
MDL No:
Molecular Formula: C9H4Cl2OS
Molecular Weight: 231.0985

Identification/Properties


Properties
Storage:
Room Temperature;Inert atmosphere;
Form:
Solid
Computed Properties
Molecular Weight:
231.09g/mol
XLogP3:
4.4
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
1
Exact Mass:
229.936g/mol
Monoisotopic Mass:
229.936g/mol
Topological Polar Surface Area:
45.3A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
222
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#:
3261
Hazard Statements:
H314
Precautionary Statements:
P280-P305+P351+P338-P310
Class:
8
Packing Group:

NMR Spectrum


Other Analytical Data


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