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250-63-5 | 5H-Thieno[2,3-c]pyrrole
CAS No: 250-63-5 Catalog No: AG002Q56 MDL No:
Product Description
Catalog Number:
AG002Q56
Chemical Name:
5H-Thieno[2,3-c]pyrrole
CAS Number:
250-63-5
Molecular Formula:
C6H5NS
Molecular Weight:
123.1756
IUPAC Name:
5H-thieno[2,3-c]pyrrole
InChI:
InChI=1S/C6H5NS/c1-2-8-6-4-7-3-5(1)6/h1-4,7H
InChI Key:
SHZBQOWKRGTTIT-UHFFFAOYSA-N
SMILES:
[nH]1cc2c(c1)ccs2
Properties
Complexity:
94.5
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
123.014g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
123.173g/mol
Monoisotopic Mass:
123.014g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
44A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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