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Details

Stereochemistry ACHIRAL
Molecular Formula C12H28N2
Molecular Weight 200.3641
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1,12-DODECANEDIAMINE

SMILES

NCCCCCCCCCCCCN

InChI

InChIKey=QFTYSVGGYOXFRQ-UHFFFAOYSA-N
InChI=1S/C12H28N2/c13-11-9-7-5-3-1-2-4-6-8-10-12-14/h1-14H2

HIDE SMILES / InChI

Description
Curator's Comment: The description was created based on several sources, including https://www.ncbi.nlm.nih.gov/pubmed/26699617 | https://www.ncbi.nlm.nih.gov/pubmed/13035672 | https://www.ncbi.nlm.nih.gov/pubmed/19648006 | https://www.ncbi.nlm.nih.gov/pubmed/26117647

1,12-Dodecanediamine (Dytek-12) is a 12 carbon aliphatic diamine. It is a highly versatile polymer monomer and chemical intermediate that is useful in the manufacture of a variety of products.

Originator

Sources: Berichte der Deutschen Chemischen Gesellschaft (1910), 42, 4541-54

Approval Year

Targets

Targets

Primary TargetPharmacologyConditionPotency
7.05 µM [IC50]
Conditions

Conditions

ConditionModalityTargetsHighest PhaseProduct
PubMed

PubMed

TitleDatePubMed
Structure and optical properties of several organic-inorganic hybrids containing corner-sharing chains of bismuth iodide octahedra.
2001 Apr 23
Layer-by-layer growth of CdSe-based nanocrystal light-emitting diodes.
2001 Mar
Complexation in pseudorotaxanes based on alpha-cyclodextrin and different alpha,omega-diaminoalkanes by NMR diffusion measurements.
2002 Apr 19
End-to-end correlation for a C-12 hydrocarbon chain.
2003 Feb
Mechanism of charging and supercharging molecules in electrospray ionization.
2003 Feb 26
Two-component dendritic gel: effect of stereochemistry on the supramolecular chiral assembly.
2004 Nov 19
Self-assembly of two-component peptidic dendrimers: dendritic effects on gel-phase materials.
2004 Oct 21
Inhalation toxicology of fumed dodecanediamine.
2004 Sep
Involvement of polyamine oxidase in abscisic acid-induced cytosolic antioxidant defense in leaves of maize.
2009 Mar
In situ studies of soft- and reactive landing of mass-selected ions using infrared reflection absorption spectroscopy.
2009 Sep 1
Polymers for colon targeted drug delivery.
2010 Nov
Patents

Sample Use Guides

LD50 (mouse, i.p.) = 191mg/kg
Route of Administration: Intraperitoneal
The cellular viability for a macrophage cell line J774 was determined by Mosmans´s MTT microcultured tetrazolium assay. We evaluated non-infected or infected macrophages with Mycobaterium bovis Bacillus Calmette-Guerin (BCG) in the presence and absence of test compounds (1,12-Dodecanediamine). The cells were plated in flat bottom 96 well plates (2.5 10^6 cells/well/100 mkL) cultured for 24 h in a controlled atmosphere (CO2 5% at 37 C), and non-adherent cells were washed by gentle flushing with RPMI 1640 supplemented with fetal bovine serum (10%) and gentamicin (25 lg/mL). Adherent cells were infected or not with BCG (2.5 10^6 UFC/well/100 mkL) cultured in the presence of medium alone, tween 20 (3%) (live and dead controls, respectively) or different concentrations of compounds (1.0, 10.0 and 100 mkg/mL) in a triplicate assay. After 48 h, stock MTT solution (5 mg/mL of saline; 20 mL/well) was added to the culture and 4 h later, the plate was centrifugate for 2 min at 2800 rpm, supernatant was discharged and Dimethyl sulfoxide (DMSO) (100 mkL/well) was added for formazan crystals solubilization and the absorbance was read at 540 nm in a plate reader.
Name Type Language
1,12-DODECANEDIAMINE
Systematic Name English
DODECAMETHYLENEDIAMINE
Systematic Name English
1,12-N-DODECANEDIAMINE
Systematic Name English
1,12-DIAMINO-N-DODECANE
Systematic Name English
1,12-DIAMINODODECANE
Systematic Name English
NSC-55050
Code English
1,12-DODECYLENEDIAMINE
Systematic Name English
1,12-DODECAMETHYLENEDIAMINE
Systematic Name English
NSC-59861
Code English
Code System Code Type Description
NSC
59861
Created by admin on Sat Dec 16 08:34:26 GMT 2023 , Edited by admin on Sat Dec 16 08:34:26 GMT 2023
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PUBCHEM
17727
Created by admin on Sat Dec 16 08:34:26 GMT 2023 , Edited by admin on Sat Dec 16 08:34:26 GMT 2023
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FDA UNII
J3LM80W9NT
Created by admin on Sat Dec 16 08:34:26 GMT 2023 , Edited by admin on Sat Dec 16 08:34:26 GMT 2023
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ECHA (EC/EINECS)
220-489-6
Created by admin on Sat Dec 16 08:34:26 GMT 2023 , Edited by admin on Sat Dec 16 08:34:26 GMT 2023
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CAS
2783-17-7
Created by admin on Sat Dec 16 08:34:26 GMT 2023 , Edited by admin on Sat Dec 16 08:34:26 GMT 2023
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EPA CompTox
DTXSID2044636
Created by admin on Sat Dec 16 08:34:26 GMT 2023 , Edited by admin on Sat Dec 16 08:34:26 GMT 2023
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NSC
55050
Created by admin on Sat Dec 16 08:34:26 GMT 2023 , Edited by admin on Sat Dec 16 08:34:26 GMT 2023
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CHEBI
49385
Created by admin on Sat Dec 16 08:34:26 GMT 2023 , Edited by admin on Sat Dec 16 08:34:26 GMT 2023
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