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869993-19-1

869993-19-1 | Octanamide, 2-amino-N-[(1S,2R)-2-phenylcyclopropyl]-, (2S)-

CAS No: 869993-19-1 Catalog No: AG004NRS MDL No:

Product Description

Catalog Number:
AG004NRS
Chemical Name:
Octanamide, 2-amino-N-[(1S,2R)-2-phenylcyclopropyl]-, (2S)-
CAS Number:
869993-19-1
Molecular Formula:
C17H26N2O
Molecular Weight:
274.4011
IUPAC Name:
(2S)-2-amino-N-[(1S,2R)-2-phenylcyclopropyl]octanamide
InChI:
InChI=1S/C17H26N2O/c1-2-3-4-8-11-15(18)17(20)19-16-12-14(16)13-9-6-5-7-10-13/h5-7,9-10,14-16H,2-4,8,11-12,18H2,1H3,(H,19,20)/t14-,15+,16+/m1/s1
InChI Key:
FJFCIAJLHDDRDT-PMPSAXMXSA-N
SMILES:
CCCCCC[C@@H](C(=O)N[C@H]1C[C@@H]1c1ccccc1)N

Properties

Complexity:
299  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
3  
Defined Bond Stereocenter Count:
0
Exact Mass:
274.205g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
274.408g/mol
Monoisotopic Mass:
274.205g/mol
Rotatable Bond Count:
8  
Topological Polar Surface Area:
55.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4  

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