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81674-82-0 | [1S,1'S,4S,5R,(+)]-3',3'a,4',5',6',6'a-Hexahydro-1'α,3'aα,4'α,6'aα-tetramethylspiro[2,6-dioxabicyclo[3.1.0]hexane-4,2'(1'H)-pentalene]-3-one
CAS No: 81674-82-0 Catalog No: AG00GJQO MDL No:
Product Description
Catalog Number:
AG00GJQO
Chemical Name:
[1S,1'S,4S,5R,(+)]-3',3'a,4',5',6',6'a-Hexahydro-1'α,3'aα,4'α,6'aα-tetramethylspiro[2,6-dioxabicyclo[3.1.0]hexane-4,2'(1'H)-pentalene]-3-one
CAS Number:
81674-82-0
IUPAC Name:
(1R,1'S,3aS,4S,5S,5'R,6aS)-1,3a,4,6a-tetramethylspiro[2,3,4,6-tetrahydro-1H-pentalene-5,4'-2,6-dioxabicyclo[3.1.0]hexane]-3'-one
InChI:
InChI=1S/C15H22O3/c1-8-5-6-13(3)9(2)15(7-14(8,13)4)10-11(17-10)18-12(15)16/h8-11H,5-7H2,1-4H3/t8-,9+,10+,11+,13+,14+,15+/m1/s1
InChI Key:
HAOKVWMBCLCRQJ-LMWHMMSDSA-N
Properties
Complexity:
447
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
7
Defined Bond Stereocenter Count:
0
Exact Mass:
250.157g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
250.338g/mol
Monoisotopic Mass:
250.157g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
38.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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