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132491-88-4 | Propanoyl chloride, 3,3'-[[2,2-bis[(3-chloro-3-oxopropoxy)methyl]-1,3-propanediyl]bis(oxy)]bis-
CAS No: 132491-88-4 Catalog No: AG0010RB MDL No:
Product Description
Catalog Number:
AG0010RB
Chemical Name:
Propanoyl chloride, 3,3'-[[2,2-bis[(3-chloro-3-oxopropoxy)methyl]-1,3-propanediyl]bis(oxy)]bis-
CAS Number:
132491-88-4
Molecular Formula:
C17H24Cl4O8
Molecular Weight:
498.1797
IUPAC Name:
3-[3-(3-chloro-3-oxopropoxy)-2,2-bis[(3-chloro-3-oxopropoxy)methyl]propoxy]propanoyl chloride
InChI:
InChI=1S/C17H24Cl4O8/c18-13(22)1-5-26-9-17(10-27-6-2-14(19)23,11-28-7-3-15(20)24)12-29-8-4-16(21)25/h1-12H2
InChI Key:
KFWYWGIJQHWHIT-UHFFFAOYSA-N
SMILES:
ClC(=O)CCOCC(COCCC(=O)Cl)(COCCC(=O)Cl)COCCC(=O)Cl
Properties
Complexity:
436
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
498.02g/mol
Formal Charge:
0
Heavy Atom Count:
29
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
498.171g/mol
Monoisotopic Mass:
496.023g/mol
Rotatable Bond Count:
20
Topological Polar Surface Area:
105A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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