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337470-46-9 | C-(5-Methyl-benzo[b]thiophen-2-yl)-methylamine
CAS No: 337470-46-9 Catalog No: AG01FA6A MDL No:
Product Description
Catalog Number:
AG01FA6A
Chemical Name:
C-(5-Methyl-benzo[b]thiophen-2-yl)-methylamine
CAS Number:
337470-46-9
Molecular Formula:
C10H11NS
Molecular Weight:
177.2660
IUPAC Name:
(5-methyl-1-benzothiophen-2-yl)methanamine
InChI:
InChI=1S/C10H11NS/c1-7-2-3-10-8(4-7)5-9(6-11)12-10/h2-5H,6,11H2,1H3
InChI Key:
ARTWFDDISCPIBU-UHFFFAOYSA-N
SMILES:
NCc1cc2c(s1)ccc(c2)C
Properties
Complexity:
160
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.061g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
177.265g/mol
Monoisotopic Mass:
177.061g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
54.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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