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178243-07-7 | 2H-Thiopyran-4-acetamide, tetrahydro-
CAS No: 178243-07-7 Catalog No: AG0025V5 MDL No:
Product Description
Catalog Number:
AG0025V5
Chemical Name:
2H-Thiopyran-4-acetamide, tetrahydro-
CAS Number:
178243-07-7
Molecular Formula:
C7H13NOS
Molecular Weight:
159.2492
IUPAC Name:
2-(thian-4-yl)acetamide
InChI:
InChI=1S/C7H13NOS/c8-7(9)5-6-1-3-10-4-2-6/h6H,1-5H2,(H2,8,9)
InChI Key:
BYWSOKLYWPJKAV-UHFFFAOYSA-N
SMILES:
NC(=O)CC1CCSCC1
Properties
Complexity:
121
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
159.072g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
159.247g/mol
Monoisotopic Mass:
159.072g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
68.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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