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60075-86-7 | Carbonic acid butyl 2-(p-iodobenzyl)butyl ester
CAS No: 60075-86-7 Catalog No: AG00EQ52 MDL No:
Product Description
Catalog Number:
AG00EQ52
Chemical Name:
Carbonic acid butyl 2-(p-iodobenzyl)butyl ester
CAS Number:
60075-86-7
IUPAC Name:
butyl 2-[(4-iodophenyl)methyl]butyl carbonate
InChI:
InChI=1S/C16H23IO3/c1-3-5-10-19-16(18)20-12-13(4-2)11-14-6-8-15(17)9-7-14/h6-9,13H,3-5,10-12H2,1-2H3
InChI Key:
QDGQMLCPXRONPA-UHFFFAOYSA-N
Properties
Complexity:
262
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
390.069g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
390.261g/mol
Monoisotopic Mass:
390.069g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
5.5
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