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1353971-70-6 | 2-Chloro-N-(4-oxo-cyclohexyl)-acetamide
CAS No: 1353971-70-6 Catalog No: AG01FCC6 MDL No:
Product Description
Catalog Number:
AG01FCC6
Chemical Name:
2-Chloro-N-(4-oxo-cyclohexyl)-acetamide
CAS Number:
1353971-70-6
Molecular Formula:
C8H12ClNO2
Molecular Weight:
189.6394
IUPAC Name:
2-chloro-N-(4-oxocyclohexyl)acetamide
InChI:
InChI=1S/C8H12ClNO2/c9-5-8(12)10-6-1-3-7(11)4-2-6/h6H,1-5H2,(H,10,12)
InChI Key:
GMJAVIPRBKBUIT-UHFFFAOYSA-N
SMILES:
ClCC(=O)NC1CCC(=O)CC1
Properties
Complexity:
184
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.056g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
189.639g/mol
Monoisotopic Mass:
189.056g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
46.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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