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1,8-Diaminooctane

CAT: 0024-sc-237797Size: 25 gDry Ice: NoHazardous: No
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CAT#:0024-sc-237797Size:25 g
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CAS Number
373-44-4

Chemical Information

1,8-Octanediamine

1,8-diaminooctane is an alkane-alpha,-diamine in which the two amino groups are separated by eight methylene groups. It derives from a hydride of an octane.

CAS Number373-44-4
PubChem CID24250
IUPAC Nameoctane-1,8-diamine
Molecular FormulaC8H20N2
Molecular Weight144.26
XLogP0.9
Topological Polar Surface Area52
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count7
Heavy Atom Count10
Formal Charge0
Complexity47
SMILES
C(CCCCN)CCCN
InChI
InChI=1S/C8H20N2/c9-7-5-3-1-2-4-6-8-10/h1-10H2
InChIKey
PWGJDPKCLMLPJW-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1,8-Octanediamine
CAS: 373-44-4
CID: 24250
Formula: C8H20N2
MW: 144.26
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight144.26
XLogP30.9
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count7
Exact Mass144.162648646
Monoisotopic Mass144.162648646
Topological Polar Surface Area52 Ų
Heavy Atom Count10
Formal Charge0
Complexity47.2
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes