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101697-79-4 | Rhenium, tetracarbonyl(tricyclohexylphosphine)-
CAS No: 101697-79-4 Catalog No: AG000584 MDL No:
Product Description
Catalog Number:
AG000584
Chemical Name:
Rhenium, tetracarbonyl(tricyclohexylphosphine)-
CAS Number:
101697-79-4
Molecular Formula:
C22H25O4PRe
Molecular Weight:
570.6123
IUPAC Name:
[4-[dicyclohexyl(oxomethylidene)-λ5-phosphanyl]-2,3-bis(oxomethylidene)cyclohexylidene]methanone;rhenium
InChI:
InChI=1S/C22H27O4P.Re/c23-13-17-11-12-22(21(15-25)20(17)14-24)27(16-26,18-7-3-1-4-8-18)19-9-5-2-6-10-19;/h18-19,22H,1-12H2;
InChI Key:
HCACMPRZWISBON-UHFFFAOYSA-N
SMILES:
O=C=C1CC(P(C2CCCCC2)C2CCCCC2)C(=C=O)C(=C=O)C1=C=O.[Re]
Properties
Complexity:
781
Compound Is Canonicalized:
No
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
573.12g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
572.635g/mol
Monoisotopic Mass:
573.12g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
68.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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