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80833-74-5 | Benzenamine, N-[(5-methyl-2-thienyl)methylene]-
CAS No: 80833-74-5 Catalog No: AG005173 MDL No:
Product Description
Catalog Number:
AG005173
Chemical Name:
Benzenamine, N-[(5-methyl-2-thienyl)methylene]-
CAS Number:
80833-74-5
Molecular Formula:
C12H11NS
Molecular Weight:
201.2874
IUPAC Name:
1-(5-methylthiophen-2-yl)-N-phenylmethanimine
InChI:
InChI=1S/C12H11NS/c1-10-7-8-12(14-10)9-13-11-5-3-2-4-6-11/h2-9H,1H3
InChI Key:
JIAYSJGPJPQMJT-UHFFFAOYSA-N
SMILES:
Cc1ccc(s1)C=Nc1ccccc1
Properties
Complexity:
197
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
201.061g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
201.287g/mol
Monoisotopic Mass:
201.061g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
40.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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