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Home > Other Heterocycles > 947534-12-5
947534-12-5 | 1,4-Dithia-8-azaspiro[4.6]undecane hydrochloride
CAS No: 947534-12-5 Catalog No: AG006SBW MDL No:MFCD11036040
Product Description
Catalog Number:
AG006SBW
Chemical Name:
1,4-Dithia-8-azaspiro[4.6]undecane hydrochloride
CAS Number:
947534-12-5
Molecular Formula:
C8H16ClNS2
Molecular Weight:
225.8023
MDL Number:
MFCD11036040
IUPAC Name:
1,4-dithia-9-azaspiro[4.6]undecane;hydrochloride
InChI:
InChI=1S/C8H15NS2.ClH/c1-2-8(3-5-9-4-1)10-6-7-11-8;/h9H,1-7H2;1H
InChI Key:
INUFMGOPPCKPMJ-UHFFFAOYSA-N
SMILES:
N1CCCC2(CC1)SCCS2.Cl
Properties
Complexity:
132
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
225.041g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
225.793g/mol
Monoisotopic Mass:
225.041g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
62.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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