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Bis (hexamethylene) triamine

CAT: 0024-sc-507254ASize: 25 gDry Ice: NoHazardous: No
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CAT#:0024-sc-507254ASize:25 g
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CAS Number
143-23-7

Chemical Information

N-(6-Aminohexyl)-1,6-hexanediamine

Bis-hexamethylene triamine appears as a colorless crystalline or flaked solid. Corrosive. Irritating to skin and eyes. May be toxic by ingestion. Used to make plastics.

CAS Number143-23-7
PubChem CID8924
IUPAC NameN'-(6-aminohexyl)hexane-1,6-diamine
Molecular FormulaC12H29N3
Molecular Weight215.38
XLogP0.8
Topological Polar Surface Area64.1
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count3
Rotatable Bond Count12
Heavy Atom Count15
Formal Charge0
Complexity95
SMILES
C(CCCNCCCCCCN)CCN
InChI
InChI=1S/C12H29N3/c13-9-5-1-3-7-11-15-12-8-4-2-6-10-14/h15H,1-14H2
InChIKey
MRNZSTMRDWRNNR-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N-(6-Aminohexyl)-1,6-hexanediamine
CAS: 143-23-7
CID: 8924
Formula: C12H29N3
MW: 215.38
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight215.38
XLogP30.8
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count3
Rotatable Bond Count12
Exact Mass215.236147938
Monoisotopic Mass215.236147938
Topological Polar Surface Area64.1 Ų
Heavy Atom Count15
Formal Charge0
Complexity95
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