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Home Carbonyls 3-Chloro-6-methoxybenzo[b]thiophene-2-carbonyl chloride

3-Chloro-6-methoxybenzo[b]thiophene-2-carbonyl chloride

CAS No.:
75998-29-7
Catalog Number:
AG003JA1
Molecular Formula:
C10H6Cl2O2S
Molecular Weight:
261.1244
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Product Description
Catalog Number:
AG003JA1
Chemical Name:
3-Chloro-6-methoxybenzo[b]thiophene-2-carbonyl chloride
CAS Number:
75998-29-7
Molecular Formula:
C10H6Cl2O2S
Molecular Weight:
261.1244
MDL Number:
MFCD00448907
IUPAC Name:
3-chloro-6-methoxy-1-benzothiophene-2-carbonyl chloride
InChI:
InChI=1S/C10H6Cl2O2S/c1-14-5-2-3-6-7(4-5)15-9(8(6)11)10(12)13/h2-4H,1H3
InChI Key:
DTMXTCKEPQWRPO-UHFFFAOYSA-N
SMILES:
COc1ccc2c(c1)sc(c2Cl)C(=O)Cl
Properties
Complexity:
262  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
259.947g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
261.116g/mol
Monoisotopic Mass:
259.947g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
54.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4  
Properties