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1492400-62-0 | 2-iodo-N-[1-(1,3-thiazol-2-yl)ethyl]aniline
CAS No: 1492400-62-0 Catalog No: AG01AW47 MDL No:MFCD21143833
Product Description
Catalog Number:
AG01AW47
Chemical Name:
2-iodo-N-[1-(1,3-thiazol-2-yl)ethyl]aniline
CAS Number:
1492400-62-0
Molecular Formula:
C11H11IN2S
Molecular Weight:
330.1879
MDL Number:
MFCD21143833
IUPAC Name:
2-iodo-N-[1-(1,3-thiazol-2-yl)ethyl]aniline
InChI:
InChI=1S/C11H11IN2S/c1-8(11-13-6-7-15-11)14-10-5-3-2-4-9(10)12/h2-8,14H,1H3
InChI Key:
LUTZGEOGZIJIFF-UHFFFAOYSA-N
SMILES:
Ic1ccccc1NC(c1nccs1)C
Properties
Complexity:
203
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
329.969g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
330.187g/mol
Monoisotopic Mass:
329.969g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
53.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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