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200552-34-7 | 7-Tetradecenamide, N-[(3S)-tetrahydro-2-oxo-3-furanyl]-, (7Z)-
CAS No: 200552-34-7 Catalog No: AG002CTQ MDL No:
Product Description
Catalog Number:
AG002CTQ
Chemical Name:
7-Tetradecenamide, N-[(3S)-tetrahydro-2-oxo-3-furanyl]-, (7Z)-
CAS Number:
200552-34-7
Molecular Formula:
C18H31NO3
Molecular Weight:
309.4436
IUPAC Name:
N-[(3S)-2-oxooxolan-3-yl]tetradec-7-enamide
InChI:
InChI=1S/C18H31NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-17(20)19-16-14-15-22-18(16)21/h7-8,16H,2-6,9-15H2,1H3,(H,19,20)/t16-/m0/s1
InChI Key:
CAUQHAIJBWAQIL-INIZCTEOSA-N
SMILES:
CCCCCC/C=C\CCCCCC(=O)N[C@H]1CCOC1=O
Properties
Complexity:
352
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
309.23g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
309.45g/mol
Monoisotopic Mass:
309.23g/mol
Rotatable Bond Count:
12
Topological Polar Surface Area:
55.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
4.9
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