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835873-11-5 | Carbamic acid, (4-ethoxy-2-iodophenyl)-, 1,1-dimethylethyl ester
CAS No: 835873-11-5 Catalog No: AG004UDR MDL No:
Product Description
Catalog Number:
AG004UDR
Chemical Name:
Carbamic acid, (4-ethoxy-2-iodophenyl)-, 1,1-dimethylethyl ester
CAS Number:
835873-11-5
Molecular Formula:
C13H18INO3
Molecular Weight:
363.1914
IUPAC Name:
tert-butyl N-(4-ethoxy-2-iodophenyl)carbamate
InChI:
InChI=1S/C13H18INO3/c1-5-17-9-6-7-11(10(14)8-9)15-12(16)18-13(2,3)4/h6-8H,5H2,1-4H3,(H,15,16)
InChI Key:
NQHWQUCAWTWKAX-UHFFFAOYSA-N
SMILES:
CCOc1ccc(c(c1)I)NC(=O)OC(C)(C)C
Properties
Complexity:
278
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
363.033g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
363.195g/mol
Monoisotopic Mass:
363.033g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
47.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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