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119060-44-5 | Spiro[2.2]pentane-1-carboxylic acid, 4,4,5,5-tetrachloro-, 1,1-dimethylethyl ester
CAS No: 119060-44-5 Catalog No: AG000I4O MDL No:MFCD01566983
Product Description
Catalog Number:
AG000I4O
Chemical Name:
Spiro[2.2]pentane-1-carboxylic acid, 4,4,5,5-tetrachloro-, 1,1-dimethylethyl ester
CAS Number:
119060-44-5
Molecular Formula:
C10H12Cl4O2
Molecular Weight:
306.0131
MDL Number:
MFCD01566983
IUPAC Name:
tert-butyl 1,1,2,2-tetrachlorospiro[2.2]pentane-5-carboxylate
InChI:
InChI=1S/C10H12Cl4O2/c1-7(2,3)16-6(15)5-4-8(5)9(11,12)10(8,13)14/h5H,4H2,1-3H3
InChI Key:
DXCZUYDOAQRWGN-UHFFFAOYSA-N
SMILES:
O=C(C1CC21C(C2(Cl)Cl)(Cl)Cl)OC(C)(C)C
Properties
Complexity:
342
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
305.956g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
306.004g/mol
Monoisotopic Mass:
303.959g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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