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Home > Other Heterocycles > 285-75-6
285-75-6 | 6-thiabicyclo[3.1.0]hexane
CAS No: 285-75-6 Catalog No: AG002VJI MDL No:MFCD20483722
Product Description
Catalog Number:
AG002VJI
Chemical Name:
6-thiabicyclo[3.1.0]hexane
CAS Number:
285-75-6
Molecular Formula:
C5H8S
Molecular Weight:
100.1820
MDL Number:
MFCD20483722
IUPAC Name:
6-thiabicyclo[3.1.0]hexane
InChI:
InChI=1S/C5H8S/c1-2-4-5(3-1)6-4/h4-5H,1-3H2
InChI Key:
GYDYAIFGNFSDAP-UHFFFAOYSA-N
SMILES:
C1CC2C(C1)S2
NSC Number:
19432
Properties
Complexity:
62.3
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
100.035g/mol
Formal Charge:
0
Heavy Atom Count:
6
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
100.179g/mol
Monoisotopic Mass:
100.035g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
25.3A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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