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89374-98-1 | 3-Octenamide, N,N-diethyl-5-methyl-
CAS No: 89374-98-1 Catalog No: AG003WN2 MDL No:
Product Description
Catalog Number:
AG003WN2
Chemical Name:
3-Octenamide, N,N-diethyl-5-methyl-
CAS Number:
89374-98-1
Molecular Formula:
C13H25NO
Molecular Weight:
211.3437
IUPAC Name:
N,N-diethyl-5-methyloct-3-enamide
InChI:
InChI=1S/C13H25NO/c1-5-9-12(4)10-8-11-13(15)14(6-2)7-3/h8,10,12H,5-7,9,11H2,1-4H3
InChI Key:
FVKVEEZLZVOFKY-UHFFFAOYSA-N
SMILES:
CCCC(C=CCC(=O)N(CC)CC)C
Properties
Complexity:
195
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.194g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
211.349g/mol
Monoisotopic Mass:
211.194g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
1
XLogP3:
3.3
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