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60075-83-4 | Isopropyl[3-(p-iodophenyl)butyl] =carbonate
CAS No: 60075-83-4 Catalog No: AG00EZ9Z MDL No:
Product Description
Catalog Number:
AG00EZ9Z
Chemical Name:
Isopropyl[3-(p-iodophenyl)butyl] =carbonate
CAS Number:
60075-83-4
IUPAC Name:
3-(4-iodophenyl)butyl propan-2-yl carbonate
InChI:
InChI=1S/C14H19IO3/c1-10(2)18-14(16)17-9-8-11(3)12-4-6-13(15)7-5-12/h4-7,10-11H,8-9H2,1-3H3
InChI Key:
BWRLYESNWMEAGD-UHFFFAOYSA-N
Properties
Complexity:
247
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
362.038g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
362.207g/mol
Monoisotopic Mass:
362.038g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6
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