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166021-27-8 | Toxaphene Parlar-No. 40, ca.1 µg/mL in Cyclohexane
CAS No: 166021-27-8 Catalog No: AG01FO0F MDL No:
Product Description
Catalog Number:
AG01FO0F
Chemical Name:
Toxaphene Parlar-No. 40, ca.1 µg/mL in Cyclohexane
CAS Number:
166021-27-8
IUPAC Name:
(2S,3S,5S,6S)-2,3,5,6-tetrachloro-7,7-bis(chloromethyl)-1-(dichloromethyl)bicyclo[2.2.1]heptane
InChI:
InChI=1S/C10H10Cl8/c11-1-9(2-12)3-4(13)6(15)10(9,8(17)18)7(16)5(3)14/h3-8H,1-2H2/t3?,4-,5-,6+,7+,10?/m0/s1
InChI Key:
JSAXRODSTJFHRO-GSSUXGFISA-N
Properties
Complexity:
312
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
4
Defined Bond Stereocenter Count:
0
Exact Mass:
413.823g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
413.79g/mol
Monoisotopic Mass:
409.829g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.4
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