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Perfluorocyclohexanecarbonyl chloride

CAT: 0024-sc-264038Size: 1 gDry Ice: NoHazardous: No
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CAT#:0024-sc-264038Size:1 g
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CAS Number
58816-79-8

Chemical Information

1,2,2,3,3,4,4,5,5,6,6-Undecafluorocyclohexane-1-carbonyl chloride
CAS Number58816-79-8
PubChem CID2778064
IUPAC Name1,2,2,3,3,4,4,5,5,6,6-undecafluorocyclohexane-1-carbonyl chloride
Molecular FormulaC7ClF11O
Molecular Weight344.51
XLogP4.1
Topological Polar Surface Area17.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count12
Rotatable Bond Count1
Heavy Atom Count20
Formal Charge0
Complexity426
SMILES
C(=O)(C1(C(C(C(C(C1(F)F)(F)F)(F)F)(F)F)(F)F)F)Cl
InChI
InChI=1S/C7ClF11O/c8-1(20)2(9)3(10,11)5(14,15)7(18,19)6(16,17)4(2,12)13
InChIKey
JBOWALSHDVHATH-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1,2,2,3,3,4,4,5,5,6,6-Undecafluorocyclohexane-1-carbonyl chloride
CAS: 58816-79-8
CID: 2778064
Formula: C7ClF11O
MW: 344.51
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight344.51
XLogP34.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count12
Rotatable Bond Count1
Exact Mass343.9462021
Monoisotopic Mass343.9462021
Topological Polar Surface Area17.1 Ų
Heavy Atom Count20
Formal Charge0
Complexity426
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
PC3715Perfluorocyclohexanecarbonyl chloride
PC5932E-01Perfluorocyclohexanecarbonyl fluoride
PC10003Perfluorocyclohexanecarbonyl bromide
189775-01Phenyl Methanesulphonyl Chloride (α-Toluenesulphonyl Chloride; Phenylmethylsulphonyl Chloride)
HY-W012954S-01TMA chloride-d12 (chloride)
3125490Tin chloride (stannous chloride)
3121645Cobalt chloride (Cobaltous chloride)
3121825Cupric chloride (Copper chloride)
TRC-B188800-5GPhenylacetyl Chloride(Benzeneacetyl Chloride)
3125225Stannous chloride (tin chloride)

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