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18342-48-8 | 1,2-Propadiene, 1-[(trichloromethyl)sulfinyl]-
CAS No: 18342-48-8 Catalog No: AG0027K8 MDL No:
Product Description
Catalog Number:
AG0027K8
Chemical Name:
1,2-Propadiene, 1-[(trichloromethyl)sulfinyl]-
CAS Number:
18342-48-8
Molecular Formula:
C4H3Cl3OS
Molecular Weight:
205.4900
IUPAC Name:
1-(trichloromethylsulfinyl)propa-1,2-diene
InChI:
InChI=1S/C4H3Cl3OS/c1-2-3-9(8)4(5,6)7/h3H,1H2
InChI Key:
DJGJAACUGHRXTB-UHFFFAOYSA-N
SMILES:
C=C=CS(=O)C(Cl)(Cl)Cl
Properties
Complexity:
165
Compound Is Canonicalized:
No
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
203.897g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
205.477g/mol
Monoisotopic Mass:
203.897g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
36.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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