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133079-80-8 | Hexanamide, 2,6-diamino-N-(2-hydroxyethyl)-, (2S)-
CAS No: 133079-80-8 Catalog No: AG001485 MDL No:
Product Description
Catalog Number:
AG001485
Chemical Name:
Hexanamide, 2,6-diamino-N-(2-hydroxyethyl)-, (2S)-
CAS Number:
133079-80-8
Molecular Formula:
C8H19N3O2
Molecular Weight:
189.2554
IUPAC Name:
2,6-diamino-N-(2-hydroxyethyl)hexanamide
InChI:
InChI=1S/C8H19N3O2/c9-4-2-1-3-7(10)8(13)11-5-6-12/h7,12H,1-6,9-10H2,(H,11,13)
InChI Key:
UOUPQABMBZMPSG-UHFFFAOYSA-N
SMILES:
NCCCC[C@@H](C(=O)NCCO)N
Properties
Complexity:
141
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.148g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
189.259g/mol
Monoisotopic Mass:
189.148g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
101A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.9
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