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87675-29-4 | 3-Thiophenamine, 4-methoxy-2-methyl-, hydrochloride
CAS No: 87675-29-4 Catalog No: AG004KEY MDL No:
Product Description
Catalog Number:
AG004KEY
Chemical Name:
3-Thiophenamine, 4-methoxy-2-methyl-, hydrochloride
CAS Number:
87675-29-4
Molecular Formula:
C6H10ClNOS
Molecular Weight:
179.6677
IUPAC Name:
4-methoxy-2-methylthiophen-3-amine;hydrochloride
InChI:
InChI=1S/C6H9NOS.ClH/c1-4-6(7)5(8-2)3-9-4;/h3H,7H2,1-2H3;1H
InChI Key:
TYOLMURFXJYNEX-UHFFFAOYSA-N
SMILES:
COc1csc(c1N)C.Cl
Properties
Complexity:
99.1
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
179.017g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
179.662g/mol
Monoisotopic Mass:
179.017g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
63.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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