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88931-82-2 | 2-Heptenamide, N,N-diethyl-7-iodo-
CAS No: 88931-82-2 Catalog No: AG0048S4 MDL No:
Product Description
Catalog Number:
AG0048S4
Chemical Name:
2-Heptenamide, N,N-diethyl-7-iodo-
CAS Number:
88931-82-2
Molecular Formula:
C11H20INO
Molecular Weight:
309.1871
IUPAC Name:
N,N-diethyl-7-iodohept-2-enamide
InChI:
InChI=1S/C11H20INO/c1-3-13(4-2)11(14)9-7-5-6-8-10-12/h7,9H,3-6,8,10H2,1-2H3
InChI Key:
QLNXKXQGBPQSMB-UHFFFAOYSA-N
SMILES:
ICCCCC=CC(=O)N(CC)CC
Properties
Complexity:
176
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
309.059g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
309.191g/mol
Monoisotopic Mass:
309.059g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
3.5
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