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383407-03-2 | 1H-Cyclopenta[5,6]thiopyrano[2,3-d]imidazole (9CI)
CAS No: 383407-03-2 Catalog No: AG00CWT2 MDL No:
Product Description
Catalog Number:
AG00CWT2
Chemical Name:
1H-Cyclopenta[5,6]thiopyrano[2,3-d]imidazole (9CI)
CAS Number:
383407-03-2
IUPAC Name:
2-thia-4,6-diazatricyclo[7.3.0.03,7]dodeca-1(12),3(7),4,8,10-pentaene
InChI:
InChI=1S/C9H6N2S/c1-2-6-4-7-9(11-5-10-7)12-8(6)3-1/h1-5H,(H,10,11)
InChI Key:
YGHJLPPPOUOTDE-UHFFFAOYSA-N
Properties
Complexity:
185
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
174.025g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
174.221g/mol
Monoisotopic Mass:
174.025g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
56.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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