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827609-21-2 | 4H-Cyclopenta[b]thiophene-5-ol, 6-amino-5,6-dihydro-, (5R,6R)-
CAS No: 827609-21-2 Catalog No: AG004YSS MDL No:
Product Description
Catalog Number:
AG004YSS
Chemical Name:
4H-Cyclopenta[b]thiophene-5-ol, 6-amino-5,6-dihydro-, (5R,6R)-
CAS Number:
827609-21-2
Molecular Formula:
C7H9NOS
Molecular Weight:
155.2175
IUPAC Name:
(5R,6R)-6-amino-5,6-dihydro-4H-cyclopenta[b]thiophen-5-ol
InChI:
InChI=1S/C7H9NOS/c8-6-5(9)3-4-1-2-10-7(4)6/h1-2,5-6,9H,3,8H2/t5-,6-/m1/s1
InChI Key:
SWMCXUWQNRFDPQ-PHDIDXHHSA-N
SMILES:
O[C@@H]1Cc2c([C@@H]1N)scc2
Properties
Complexity:
142
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
155.04g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
155.215g/mol
Monoisotopic Mass:
155.04g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
74.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1
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