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128861-78-9 | 3-Thietanamine, hydrochloride (1:1)
CAS No: 128861-78-9 Catalog No: AG000YFO MDL No:MFCD19982300
Product Description
Catalog Number:
AG000YFO
Chemical Name:
3-Thietanamine, hydrochloride (1:1)
CAS Number:
128861-78-9
Molecular Formula:
C3H8ClNS
Molecular Weight:
125.6203
MDL Number:
MFCD19982300
IUPAC Name:
thietan-3-amine;hydrochloride
InChI:
InChI=1S/C3H7NS.ClH/c4-3-1-5-2-3;/h3H,1-2,4H2;1H
InChI Key:
DELHLMMLBSGUAE-UHFFFAOYSA-N
SMILES:
NC1CSC1.Cl
Properties
Complexity:
33.9
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
125.007g/mol
Formal Charge:
0
Heavy Atom Count:
6
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
125.614g/mol
Monoisotopic Mass:
125.007g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
51.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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