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260552-19-0 | 3H-Thiireno[i]indolizine (9CI)
CAS No: 260552-19-0 Catalog No: AG002RIU MDL No:
Product Description
Catalog Number:
AG002RIU
Chemical Name:
3H-Thiireno[i]indolizine (9CI)
CAS Number:
260552-19-0
Molecular Formula:
C8H7NS
Molecular Weight:
149.2129
IUPAC Name:
3H-thiireno[2,3-i]indolizine
InChI:
InChI=1S/C8H7NS/c1-2-5-9-6-3-7-8(9,4-1)10-7/h1-5H,6H2
InChI Key:
VZPPTUMFTFQOFJ-UHFFFAOYSA-N
SMILES:
C1=CN2C3(C=C1)SC3=CC2
Properties
Complexity:
277
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
149.03g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
149.211g/mol
Monoisotopic Mass:
149.03g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
28.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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