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114263-97-7 | Naphthalene, 1,2,3,4-tetrachloro-1-(1-chloroethyl)-1,2,3,4-tetrahydro-
CAS No: 114263-97-7 Catalog No: AG000AY6 MDL No:
Product Description
Catalog Number:
AG000AY6
Chemical Name:
Naphthalene, 1,2,3,4-tetrachloro-1-(1-chloroethyl)-1,2,3,4-tetrahydro-
CAS Number:
114263-97-7
Molecular Formula:
C12H11Cl5
Molecular Weight:
332.4807
IUPAC Name:
1,2,3,4-tetrachloro-4-(1-chloroethyl)-2,3-dihydro-1H-naphthalene
InChI:
InChI=1S/C12H11Cl5/c1-6(13)12(17)8-5-3-2-4-7(8)9(14)10(15)11(12)16/h2-6,9-11H,1H3
InChI Key:
LLQAHRSKFVQXHR-UHFFFAOYSA-N
SMILES:
ClC1C(Cl)C(Cl)C(c2c1cccc2)(Cl)C(Cl)C
Properties
Complexity:
284
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
331.927g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
332.47g/mol
Monoisotopic Mass:
329.93g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
5
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7
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