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1021871-63-5 | Benzo[b]thiophene-4-methanamine, hydrochloride (1:1)
CAS No: 1021871-63-5 Catalog No: AG0006UJ MDL No:
Product Description
Catalog Number:
AG0006UJ
Chemical Name:
Benzo[b]thiophene-4-methanamine, hydrochloride (1:1)
CAS Number:
1021871-63-5
Molecular Formula:
C9H10ClNS
Molecular Weight:
199.7004
IUPAC Name:
1-benzothiophen-4-ylmethanamine;hydrochloride
InChI:
InChI=1S/C9H9NS.ClH/c10-6-7-2-1-3-9-8(7)4-5-11-9;/h1-5H,6,10H2;1H
InChI Key:
DEMAGAMEQGZNFD-UHFFFAOYSA-N
SMILES:
NCc1cccc2c1ccs2.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:
199.022g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
199.696g/mol
Monoisotopic Mass:
199.022g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
54.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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