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15618-65-2

15618-65-2 | Carbonodiperoxoic acid, bis(2-ethylhexyl) ester

CAS No: 15618-65-2 Catalog No: AG001OKO MDL No:

Product Description

Catalog Number:
AG001OKO
Chemical Name:
Carbonodiperoxoic acid, bis(2-ethylhexyl) ester
CAS Number:
15618-65-2
Molecular Formula:
C17H34O5
Molecular Weight:
318.4489
IUPAC Name:
bis(2-ethylhexoxy) carbonate
InChI:
InChI=1S/C17H34O5/c1-5-9-11-15(7-3)13-19-21-17(18)22-20-14-16(8-4)12-10-6-2/h15-16H,5-14H2,1-4H3
InChI Key:
MONDOAXQDOCXQW-UHFFFAOYSA-N
SMILES:
CCCCC(COOC(=O)OOCC(CCCC)CC)CC
EC Number:
239-694-7

Properties

Complexity:
233  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
318.241g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
318.454g/mol
Monoisotopic Mass:
318.241g/mol
Rotatable Bond Count:
16  
Topological Polar Surface Area:
54A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
6.9  

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