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1464732-17-9 | 2-iodo-N-[(4-methyl-1,3-thiazol-5-yl)methyl]aniline
CAS No: 1464732-17-9 Catalog No: AG01AWBK MDL No:MFCD21294123
Product Description
Catalog Number:
AG01AWBK
Chemical Name:
2-iodo-N-[(4-methyl-1,3-thiazol-5-yl)methyl]aniline
CAS Number:
1464732-17-9
Molecular Formula:
C11H11IN2S
Molecular Weight:
330.1879
MDL Number:
MFCD21294123
IUPAC Name:
2-iodo-N-[(4-methyl-1,3-thiazol-5-yl)methyl]aniline
InChI:
InChI=1S/C11H11IN2S/c1-8-11(15-7-14-8)6-13-10-5-3-2-4-9(10)12/h2-5,7,13H,6H2,1H3
InChI Key:
CHCUTBFAJSMRFF-UHFFFAOYSA-N
SMILES:
Ic1ccccc1NCc1scnc1C
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:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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