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2036-92-2 | Carbonodiperoxoic acid, dicyclohexyl ester
CAS No: 2036-92-2 Catalog No: AG002911 MDL No:
Product Description
Catalog Number:
AG002911
Chemical Name:
Carbonodiperoxoic acid, dicyclohexyl ester
CAS Number:
2036-92-2
Molecular Formula:
C13H22O5
Molecular Weight:
258.3108
IUPAC Name:
dicyclohexyloxy carbonate
InChI:
InChI=1S/C13H22O5/c14-13(17-15-11-7-3-1-4-8-11)18-16-12-9-5-2-6-10-12/h11-12H,1-10H2
InChI Key:
JTZMVYPFTMBXQL-UHFFFAOYSA-N
SMILES:
O=C(OOC1CCCCC1)OOC1CCCCC1
EC Number:
218-007-4
Properties
Complexity:
220
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
258.147g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
258.314g/mol
Monoisotopic Mass:
258.147g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
54A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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