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15104-61-7 | Propane, 1,1,2,3,3-pentachloro-
CAS No: 15104-61-7 Catalog No: AG001N19 MDL No:MFCD00018862
Product Description
Catalog Number:
AG001N19
Chemical Name:
Propane, 1,1,2,3,3-pentachloro-
CAS Number:
15104-61-7
Molecular Formula:
C3H3Cl5
Molecular Weight:
216.3209
MDL Number:
MFCD00018862
IUPAC Name:
1,1,2,3,3-pentachloropropane
InChI:
InChI=1S/C3H3Cl5/c4-1(2(5)6)3(7)8/h1-3H
InChI Key:
PANVCEBTPSTUEL-UHFFFAOYSA-N
SMILES:
ClC(C(Cl)Cl)C(Cl)Cl
Properties
Complexity:
52.7
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
215.865g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
216.307g/mol
Monoisotopic Mass:
213.868g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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