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100044-40-4 | Ethanone, 2-amino-1-(5-methyl-2-thienyl)-, hydrochloride (1:1)
CAS No: 100044-40-4 Catalog No: AG0000NV MDL No:
Product Description
Catalog Number:
AG0000NV
Chemical Name:
Ethanone, 2-amino-1-(5-methyl-2-thienyl)-, hydrochloride (1:1)
CAS Number:
100044-40-4
Molecular Formula:
C7H10ClNOS
Molecular Weight:
191.6784
IUPAC Name:
2-amino-1-(5-methylthiophen-2-yl)ethanone;hydrochloride
InChI:
InChI=1S/C7H9NOS.ClH/c1-5-2-3-7(10-5)6(9)4-8;/h2-3H,4,8H2,1H3;1H
InChI Key:
JWZUEGLJRKPWAS-UHFFFAOYSA-N
SMILES:
Cc1ccc(s1)C(=O)CN.Cl
Properties
Complexity:
138
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.017g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
191.673g/mol
Monoisotopic Mass:
191.017g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
71.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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