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2935-89-9 | Propanamide, N-cyclohexyl-3-mercapto-
CAS No: 2935-89-9 Catalog No: AG002Y4J MDL No:
Product Description
Catalog Number:
AG002Y4J
Chemical Name:
Propanamide, N-cyclohexyl-3-mercapto-
CAS Number:
2935-89-9
Molecular Formula:
C9H17NOS
Molecular Weight:
187.3024
IUPAC Name:
N-cyclohexyl-3-sulfanylpropanamide
InChI:
InChI=1S/C9H17NOS/c11-9(6-7-12)10-8-4-2-1-3-5-8/h8,12H,1-7H2,(H,10,11)
InChI Key:
IILDNJFHFXLQQU-UHFFFAOYSA-N
SMILES:
SCCC(=O)NC1CCCCC1
Properties
Complexity:
144
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
187.103g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
187.301g/mol
Monoisotopic Mass:
187.103g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
30.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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