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143746-70-7 | Naphtho[2,3-b]thiophene-4,9-dione, 6,7-dichloro-
CAS No: 143746-70-7 Catalog No: AG001IB7 MDL No:
Product Description
Catalog Number:
AG001IB7
Chemical Name:
Naphtho[2,3-b]thiophene-4,9-dione, 6,7-dichloro-
CAS Number:
143746-70-7
Molecular Formula:
C12H4Cl2O2S
Molecular Weight:
283.1300
IUPAC Name:
6,7-dichlorobenzo[f][1]benzothiole-4,9-dione
InChI:
InChI=1S/C12H4Cl2O2S/c13-8-3-6-7(4-9(8)14)11(16)12-5(10(6)15)1-2-17-12/h1-4H
InChI Key:
QFZYTAVGUJSAAT-UHFFFAOYSA-N
SMILES:
Clc1cc2c(cc1Cl)C(=O)c1c(C2=O)scc1
Properties
Complexity:
374
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
281.931g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
283.122g/mol
Monoisotopic Mass:
281.931g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
62.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
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