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72853-06-6 | Cyclopropane, 1-chloro-2-propyl-1-(trichloroethenyl)-
CAS No: 72853-06-6 Catalog No: AG005E80 MDL No:
Product Description
Catalog Number:
AG005E80
Chemical Name:
Cyclopropane, 1-chloro-2-propyl-1-(trichloroethenyl)-
CAS Number:
72853-06-6
Molecular Formula:
C8H10Cl4
Molecular Weight:
247.9770
IUPAC Name:
1-chloro-2-propyl-1-(1,2,2-trichloroethenyl)cyclopropane
InChI:
InChI=1S/C8H10Cl4/c1-2-3-5-4-8(5,12)6(9)7(10)11/h5H,2-4H2,1H3
InChI Key:
HJFBVIBPVLQDFF-UHFFFAOYSA-N
SMILES:
CCCC1CC1(Cl)C(=C(Cl)Cl)Cl
Properties
Complexity:
207
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.951g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
247.968g/mol
Monoisotopic Mass:
245.954g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7
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