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60075-91-4 | Carbonic acid hexyl 3,5-diiodobenzyl ester
CAS No: 60075-91-4 Catalog No: AG00EQ57 MDL No:
Product Description
Catalog Number:
AG00EQ57
Chemical Name:
Carbonic acid hexyl 3,5-diiodobenzyl ester
CAS Number:
60075-91-4
IUPAC Name:
(3,5-diiodophenyl)methyl hexyl carbonate
InChI:
InChI=1S/C14H18I2O3/c1-2-3-4-5-6-18-14(17)19-10-11-7-12(15)9-13(16)8-11/h7-9H,2-6,10H2,1H3
InChI Key:
GTEXUJKMQCYMIY-UHFFFAOYSA-N
Properties
Complexity:
251
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
487.935g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
488.104g/mol
Monoisotopic Mass:
487.935g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.6
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