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28854-77-5 | 1,4-Dioxane, bis(chloromethyl)- (9CI)
CAS No: 28854-77-5 Catalog No: AG002WUD MDL No:
Product Description
Catalog Number:
AG002WUD
Chemical Name:
1,4-Dioxane, bis(chloromethyl)- (9CI)
CAS Number:
28854-77-5
Molecular Formula:
C6H10Cl2O2
Molecular Weight:
185.0484
IUPAC Name:
2,2-bis(chloromethyl)-1,4-dioxane
InChI:
InChI=1S/C6H10Cl2O2/c7-3-6(4-8)5-9-1-2-10-6/h1-5H2
InChI Key:
UCZCTKXMBGBHCP-UHFFFAOYSA-N
SMILES:
ClCC1(CCl)OCCOC1
Properties
Complexity:
104
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
184.006g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
185.044g/mol
Monoisotopic Mass:
184.006g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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