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85866-13-3 | 2-OXONONAN-1-AMIDE
CAS No: 85866-13-3 Catalog No: AG004R49 MDL No:
Product Description
Catalog Number:
AG004R49
Chemical Name:
2-OXONONAN-1-AMIDE
CAS Number:
85866-13-3
Molecular Formula:
C9H17NO2
Molecular Weight:
171.2368
IUPAC Name:
2-oxononanamide
InChI:
InChI=1S/C9H17NO2/c1-2-3-4-5-6-7-8(11)9(10)12/h2-7H2,1H3,(H2,10,12)
InChI Key:
GGPGBWZFDWFGBZ-UHFFFAOYSA-N
SMILES:
CCCCCCCC(=O)C(=O)N
EC Number:
288-716-1
Properties
Complexity:
155
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
171.126g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
171.24g/mol
Monoisotopic Mass:
171.126g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
60.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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