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98952-64-8 | Carbamic acid, (2-iodophenyl)-, ethyl ester
CAS No: 98952-64-8 Catalog No: AG006QFL MDL No:
Product Description
Catalog Number:
AG006QFL
Chemical Name:
Carbamic acid, (2-iodophenyl)-, ethyl ester
CAS Number:
98952-64-8
Molecular Formula:
C9H10INO2
Molecular Weight:
291.0857
IUPAC Name:
ethyl N-(2-iodophenyl)carbamate
InChI:
InChI=1S/C9H10INO2/c1-2-13-9(12)11-8-6-4-3-5-7(8)10/h3-6H,2H2,1H3,(H,11,12)
InChI Key:
DNKIYMNEYFDMPS-UHFFFAOYSA-N
SMILES:
CCOC(=O)Nc1ccccc1I
Properties
Complexity:
175
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
290.976g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
291.088g/mol
Monoisotopic Mass:
290.976g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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