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1341947-29-2 | 2-iodo-N-(1,3-thiazol-5-ylmethyl)aniline
CAS No: 1341947-29-2 Catalog No: AG01AV9B MDL No:MFCD16865495
Product Description
Catalog Number:
AG01AV9B
Chemical Name:
2-iodo-N-(1,3-thiazol-5-ylmethyl)aniline
CAS Number:
1341947-29-2
Molecular Formula:
C10H9IN2S
Molecular Weight:
316.1613
MDL Number:
MFCD16865495
IUPAC Name:
2-iodo-N-(1,3-thiazol-5-ylmethyl)aniline
InChI:
InChI=1S/C10H9IN2S/c11-9-3-1-2-4-10(9)13-6-8-5-12-7-14-8/h1-5,7,13H,6H2
InChI Key:
QEILPCMELGZSJG-UHFFFAOYSA-N
SMILES:
Ic1ccccc1NCc1cncs1
Properties
Complexity:
180
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
315.953g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
316.16g/mol
Monoisotopic Mass:
315.953g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
53.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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