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Home > Other Heterocycles > 920491-09-4
920491-09-4 | 2-Thia-6-azaspiro[3.3]heptane
CAS No: 920491-09-4 Catalog No: AG00IH0F MDL No:MFCD17017542
Product Description
Catalog Number:
AG00IH0F
Chemical Name:
2-Thia-6-azaspiro[3.3]heptane
CAS Number:
920491-09-4
Molecular Formula:
C5H9NS
Molecular Weight:
115.1967
MDL Number:
MFCD17017542
IUPAC Name:
2-thia-6-azaspiro[3.3]heptane
InChI:
InChI=1S/C5H9NS/c1-5(2-6-1)3-7-4-5/h6H,1-4H2
InChI Key:
PHMKOQSDCVHJFT-UHFFFAOYSA-N
SMILES:
N1CC2(C1)CSC2
Properties
Complexity:
82.1
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
115.046g/mol
Formal Charge:
0
Heavy Atom Count:
7
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
115.194g/mol
Monoisotopic Mass:
115.046g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1
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