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886494-02-6 | Dimethyl-(5-methyl-benzo[b]thiophen-2-ylmethyl)-amine
CAS No: 886494-02-6 Catalog No: AG01F8D5 MDL No:
Product Description
Catalog Number:
AG01F8D5
Chemical Name:
Dimethyl-(5-methyl-benzo[b]thiophen-2-ylmethyl)-amine
CAS Number:
886494-02-6
Molecular Formula:
C12H15NS
Molecular Weight:
205.3192
IUPAC Name:
N,N-dimethyl-1-(5-methyl-1-benzothiophen-2-yl)methanamine
InChI:
InChI=1S/C12H15NS/c1-9-4-5-12-10(6-9)7-11(14-12)8-13(2)3/h4-7H,8H2,1-3H3
InChI Key:
PLFALEXIBRJFPD-UHFFFAOYSA-N
SMILES:
CN(Cc1cc2c(s1)ccc(c2)C)C
Properties
Complexity:
193
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
205.093g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
205.319g/mol
Monoisotopic Mass:
205.093g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
31.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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