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Home > Other Heterocycles > 84364-96-5
84364-96-5 | 3-(1-dimethylarsanylsulfanyl-2-hydroxy-ethyl)-7,7-dimethyl-2,6,8-trioxabicyclo[3.3.0]octan-4-ol
CAS No: 84364-96-5 Catalog No: AG004X6S MDL No:
Product Description
Catalog Number:
AG004X6S
Chemical Name:
3-(1-dimethylarsanylsulfanyl-2-hydroxy-ethyl)-7,7-dimethyl-2,6,8-trioxabicyclo[3.3.0]octan-4-ol
CAS Number:
84364-96-5
Molecular Formula:
C11H21AsO5S
Molecular Weight:
340.2680
IUPAC Name:
5-(1-dimethylarsanylsulfanyl-2-hydroxyethyl)-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-6-ol
InChI:
InChI=1S/C11H21AsO5S/c1-11(2)16-9-7(14)8(15-10(9)17-11)6(5-13)18-12(3)4/h6-10,13-14H,5H2,1-4H3
InChI Key:
CXBDEZDAGCOKIY-UHFFFAOYSA-N
SMILES:
OCC(C1OC2C(C1O)OC(O2)(C)C)S[As](C)C
NSC Number:
314623
Properties
Complexity:
301
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
340.033g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
340.266g/mol
Monoisotopic Mass:
340.033g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
93.4A^2
Undefined Atom Stereocenter Count:
5
Undefined Bond Stereocenter Count:
0
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