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1561-41-7 | Propane, 1,1,1,3-tetrachloro-3-ethoxy-
CAS No: 1561-41-7 Catalog No: AG001OIM MDL No:MFCD22054740
Product Description
Catalog Number:
AG001OIM
Chemical Name:
Propane, 1,1,1,3-tetrachloro-3-ethoxy-
CAS Number:
1561-41-7
Molecular Formula:
C5H8Cl4O
Molecular Weight:
225.9284
MDL Number:
MFCD22054740
IUPAC Name:
1,1,1,3-tetrachloro-3-ethoxypropane
InChI:
InChI=1S/C5H8Cl4O/c1-2-10-4(6)3-5(7,8)9/h4H,2-3H2,1H3
InChI Key:
QXQVBEYDHRVIHY-UHFFFAOYSA-N
SMILES:
CCOC(CC(Cl)(Cl)Cl)Cl
Properties
Complexity:
90.1
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
225.93g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
225.918g/mol
Monoisotopic Mass:
223.933g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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