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145328-93-4

145328-93-4 | Hexanoic acid, 6-[[6-[(aminoiminomethyl)amino]-1-oxohexyl]amino]-

CAS No: 145328-93-4 Catalog No: AG001KSV MDL No:

Product Description

Catalog Number:
AG001KSV
Chemical Name:
Hexanoic acid, 6-[[6-[(aminoiminomethyl)amino]-1-oxohexyl]amino]-
CAS Number:
145328-93-4
Molecular Formula:
C13H26N4O3
Molecular Weight:
286.3705
IUPAC Name:
6-[6-(diaminomethylideneamino)hexanoylamino]hexanoic acid
InChI:
InChI=1S/C13H26N4O3/c14-13(15)17-10-6-1-3-7-11(18)16-9-5-2-4-8-12(19)20/h1-10H2,(H,16,18)(H,19,20)(H4,14,15,17)
InChI Key:
GHUCSEDQJUERDZ-UHFFFAOYSA-N
SMILES:
NN=CNCCCCCC(=O)NCCCCCC(=O)O

Properties

Complexity:
315  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
286.2g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
286.376g/mol
Monoisotopic Mass:
286.2g/mol
Rotatable Bond Count:
12  
Topological Polar Surface Area:
131A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.4  

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