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Home > Thiazole > 1052542-41-2
1052542-41-2 | 4-(1,3-thiazol-2-yl)aniline hydrochloride
CAS No: 1052542-41-2 Catalog No: AG019JXH MDL No:MFCD06688765
Product Description
Catalog Number:
AG019JXH
Chemical Name:
4-(1,3-thiazol-2-yl)aniline hydrochloride
CAS Number:
1052542-41-2
Molecular Formula:
C9H9ClN2S
Molecular Weight:
212.6992
MDL Number:
MFCD06688765
IUPAC Name:
4-(1,3-thiazol-2-yl)aniline;hydrochloride
InChI:
InChI=1S/C9H8N2S.ClH/c10-8-3-1-7(2-4-8)9-11-5-6-12-9;/h1-6H,10H2;1H
InChI Key:
QAFFOXKTSRXKND-UHFFFAOYSA-N
SMILES:
Nc1ccc(cc1)c1nccs1.Cl
Properties
Complexity:
144
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.017g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
212.695g/mol
Monoisotopic Mass:
212.017g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
67.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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