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2172051-90-8 | 2-methyl-2-(thiomorpholin-4-yl)propan-1-amine dihydrochloride
CAS No: 2172051-90-8 Catalog No: AG01FJCD MDL No:
Product Description
Catalog Number:
AG01FJCD
Chemical Name:
2-methyl-2-(thiomorpholin-4-yl)propan-1-amine dihydrochloride
CAS Number:
2172051-90-8
Molecular Formula:
C8H20Cl2N2S
Molecular Weight:
247.2288
IUPAC Name:
2-methyl-2-thiomorpholin-4-ylpropan-1-amine;dihydrochloride
InChI:
InChI=1S/C8H18N2S.2ClH/c1-8(2,7-9)10-3-5-11-6-4-10;;/h3-7,9H2,1-2H3;2*1H
InChI Key:
MUTXYUWDOHVQRX-UHFFFAOYSA-N
SMILES:
NCC(N1CCSCC1)(C)C.Cl.Cl
Properties
Complexity:
119
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
246.072g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
247.222g/mol
Monoisotopic Mass:
246.072g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
54.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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