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886497-72-9

886497-72-9 | tert-Butyl (2-fluoro-4-iodophenyl)carbamate

CAS No: 886497-72-9 Catalog No: AG004900 MDL No:MFCD06797742

Product Description

Catalog Number:
AG004900
Chemical Name:
tert-Butyl (2-fluoro-4-iodophenyl)carbamate
CAS Number:
886497-72-9
Molecular Formula:
C11H13FINO2
Molecular Weight:
337.1293
MDL Number:
MFCD06797742
IUPAC Name:
tert-butyl N-(2-fluoro-4-iodophenyl)carbamate
InChI:
InChI=1S/C11H13FINO2/c1-11(2,3)16-10(15)14-9-5-4-7(13)6-8(9)12/h4-6H,1-3H3,(H,14,15)
InChI Key:
QPMNEDDPZQDRRB-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)Nc1ccc(cc1F)I

Properties

Complexity:
255  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
336.998g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
337.133g/mol
Monoisotopic Mass:
336.998g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2  

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