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143390-49-2 | tert-Butyl (3-iodophenyl)carbamate
CAS No: 143390-49-2 Catalog No: AG007K6K MDL No:MFCD08703142
Product Description
Catalog Number:
AG007K6K
Chemical Name:
tert-Butyl (3-iodophenyl)carbamate
CAS Number:
143390-49-2
Molecular Formula:
C11H14INO2
Molecular Weight:
319.1388
MDL Number:
MFCD08703142
IUPAC Name:
tert-butyl N-(3-iodophenyl)carbamate
InChI:
InChI=1S/C11H14INO2/c1-11(2,3)15-10(14)13-9-6-4-5-8(12)7-9/h4-7H,1-3H3,(H,13,14)
InChI Key:
MPCQRNOVFYBCTQ-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)Nc1cccc(c1)I
Properties
Complexity:
225
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
319.007g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
319.142g/mol
Monoisotopic Mass:
319.007g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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