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150986-82-6 | 5H-Thieno[2,3-c]pyran-3-carbonitrile, 2-amino-4,7-dihydro-
CAS No: 150986-82-6 Catalog No: AG001MZ2 MDL No:MFCD00221038
Product Description
Catalog Number:
AG001MZ2
Chemical Name:
5H-Thieno[2,3-c]pyran-3-carbonitrile, 2-amino-4,7-dihydro-
CAS Number:
150986-82-6
Molecular Formula:
C8H8N2OS
Molecular Weight:
180.2269
MDL Number:
MFCD00221038
IUPAC Name:
2-amino-5,7-dihydro-4H-thieno[2,3-c]pyran-3-carbonitrile
InChI:
InChI=1S/C8H8N2OS/c9-3-6-5-1-2-11-4-7(5)12-8(6)10/h1-2,4,10H2
InChI Key:
XCCSOSJCWRZLPA-UHFFFAOYSA-N
SMILES:
N#Cc1c(N)sc2c1CCOC2
Properties
Complexity:
224
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
180.036g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
180.225g/mol
Monoisotopic Mass:
180.036g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
87.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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