2,2-dimethyl-1,3-propanediamine
Product Information
Molecular Formula
C5H14N2
Molecular Weight
102.1781
Description
Applications: 2,2-Dimethylpropanediamine is a reagent used in a novel terephthalato complexes as a antimicrobial agent and possesses DNA cleavage activity.Dangerous Goods Info: Not a dangerous good if item is equal to or less than 1g/ml and there is less than 100g/ml in the package.
Synonyms
2,2-DIMETHYL-1,3-PROPANEDIAMINE; 2,2-DIMETHYLPROPYLENEDIAMINE; 1,3-DIAMINO-2,2-DIMETHYLPROPANE; RARECHEM AL BW 2308; NEOPENTANEDIAMINE; 1,3-Propanediamine, 2,2-dimethyl-; 2,2-dimethyl-3-propanediamine; 2,2-Dimethyltrimethylenediamine
IUPAC Name
2,2-dimethylpropane-1,3-diamine
SMILES
CC(C)(CN)CN
InChI
InChI=1S/C5H14N2/c1-5(2,3-6)4-7/h3-4,6-7H2,1-2H3
InChI Key
DDHUNHGZUHZNKB-UHFFFAOYSA-N
Boiling Point
65 °C/15 mmHg
Melting Point
27 °C
Flash Point
116.6 °CF - closed cup
Purity
>98.0%(GC)(T)
Density
0.862 g/cm3
Appearance
White or Colorless to Almost white or Almost colorless powder to lump to clear liquid
Refractive Index
n20/D 1.4566 (lit.)
Safety Information
Hazards
H228:
Flammable solid.
H314:
Causes severe skin burns and eye damage.
Flammable solid.
H314:
Causes severe skin burns and eye damage.
Precautionary Statement
P210:
Keep away from heat, sparks, open flames, hot surfaces. No smoking.
P260:
Do not breathe dust, fumes, gas, mist, vapours, spray.
P280:
Wear protective gloves/protective clothing/eye protection/face protection.
P303+P361+P353:
IF ON SKIN (or hair):
Take off immediately all contaminated clothing. [As modified by IV ATP].
Rinse skin with water/shower.
P304+P340+P310:
IF INHALED:
Remove person to fresh air and keep comfortable for breathing.
Immediately call a POISON CENTER or doctor/physician.
P305+P351+P338+P310:
IF IN EYES:
Rinse cautiously with water for several minutes.
Remove contact lenses if present and easy to do. Continue rinsing.
Immediately call a POISON CENTER or doctor/physician.
P370+P378:
In case of fire:
Use for extinction:
Keep away from heat, sparks, open flames, hot surfaces. No smoking.
P260:
Do not breathe dust, fumes, gas, mist, vapours, spray.
P280:
Wear protective gloves/protective clothing/eye protection/face protection.
P303+P361+P353:
IF ON SKIN (or hair):
Take off immediately all contaminated clothing. [As modified by IV ATP].
Rinse skin with water/shower.
P304+P340+P310:
IF INHALED:
Remove person to fresh air and keep comfortable for breathing.
Immediately call a POISON CENTER or doctor/physician.
P305+P351+P338+P310:
IF IN EYES:
Rinse cautiously with water for several minutes.
Remove contact lenses if present and easy to do. Continue rinsing.
Immediately call a POISON CENTER or doctor/physician.
P370+P378:
In case of fire:
Use for extinction:
Computed Properties
XLogP3
-0.5
Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
2
Rotatable Bond Count
2
Exact Mass
102.115698455 g/mol
Monoisotopic Mass
102.115698455 g/mol
Topological Polar Surface Area
52Ų
Heavy Atom Count
7
Formal Charge
0
Complexity
44
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
1
Compound Is Canonicalized
Yes
Patents
| Publication Number | Title | Priority Date |
|---|---|---|
| CN-114014845-A | Epoxy group-containing compound, liquid crystal aligning agent, and preparation method and application thereof | 2021-11-18 |
| CN-113234298-A | High-performance LDPE ionic polymer and preparation method thereof | 2021-06-10 |
| AU-2021101355-A4 | Nanocarriers for treatment of breast cancer | 2021-03-16 |
| JP-2021055107-A | Urethane (meth) acrylate oligomer | 2020-12-22 |
| JP-6864775-B1 | Thermoplastic resin foam sheet, thermoplastic resin foam sheet molded product and manufacturing method thereof | 2020-10-28 |
| JP-2022027384-A | Thermoplastic resin foam sheet, thermoplastic resin foam sheet molded body and manufacturing method thereof | 2020-10-28 |
| WO-2022049070-A1 | Electrically conductive epoxy resin coating and electrostatically dissipative floor | 2020-09-01 |
| WO-2022049071-A1 | Transparent electrically conductive epoxy resin coating and electrostatic dissipative floor | 2020-09-01 |
| WO-2022043160-A1 | Electrically conductive one component (1k) epoxy formulation | 2020-08-27 |
| EP-3960718-A1 | Mortar system | 2020-08-24 |
Literatures
| PMID | Publication Date | Title | Journal |
|---|---|---|---|
| 22885931 | 2012-11-01 | New tetradentate Schiff bases of 2,2-dimethyl-1,3-diaminopropane and acetylacetone derivatives and their vanadyl complexes | Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy |
| 22763686 | 2012-07-01 | π-π Dimerization of a mono(pyridyl-imine) platinum(II) chelate | Acta crystallographica. Section C, Crystal structure communications |
| 22412483 | 2012-03-01 | 2-((E)-{3-[(E)-2-Hy-droxy-3,5-diiodo-benzyl-idene-amino]-2,2-dimethyl-prop-yl}imino-meth-yl)-4,6-diiodo-phenol | Acta crystallographica. Section E, Structure reports online |
| 22346957 | 2012-02-01 | 2,4-Dibromo-6-[(E)-({3-[(E)-(3,5-dibromo-2-oxidobenzyl-idene)aza-nium-yl]-2,2-dimethyl-prop-yl}iminium-yl)meth-yl]phenolate | Acta crystallographica. Section E, Structure reports online |
| 22259428 | 2012-01-01 | 4,6-Dichloro-2-{[(E)-(3-{[(E)-3,5-dichloro-2-hy-droxy-benzyl-idene]amino}-2,2-dimethyl-prop-yl)imino]-meth-yl}phenol | Acta crystallographica. Section E, Structure reports online |
| 22071076 | 2011-12-01 | Influence of the geometry around the manganese ion on the peroxidase and catalase activities of Mn(III)-Schiff base complexes | Journal of inorganic biochemistry |
| 22058812 | 2011-10-01 | 2-{(1E)-1-[(3-{(E)-[1-(2-Hy-droxy-4-meth-oxy-phen-yl)ethyl-idene]amino}-2,2-di-methyl-prop-yl)imino]-eth-yl}-5-meth-oxy-phenol | Acta crystallographica. Section E, Structure reports online |
| 21753968 | 2011-04-01 | {4,4'-Dibromo-2,2'-[2,2-dimethyl-propane-1,3-diylbis(nitrilo-methanylyl-idene)]diphenolato-κO,N,N',O'}nickel(II) | Acta crystallographica. Section E, Structure reports online |
| 21522301 | 2011-02-26 | trans-Dichloridobis(propane-1,3-diamine-κN,N')chromium(III) perchlorate | Acta crystallographica. Section E, Structure reports online |
| 21522371 | 2011-02-12 | 4,4'-Dimeth-oxy-2,2'-[2,2-dimethyl-propane-1,3-diylbis(nitrilo-methanylyl-idene)]diphenol | Acta crystallographica. Section E, Structure reports online |
