1,4-Diaminobutane dihydrochloride
Product Information
Molecular Formula
C4H12N2.2HCl
Molecular Weight
161.07
Description
It is an NMDA receptor agonist produced by the breakdown of amino acids after the death of an organism. It is a polyamine plant growth regulator affecting the synthesis of macromolecules and the development of root systems in plants.
Synonyms
1,4-Butanediamine Dihydrochloride; Putrescine Dihydrochloride; Putrescine Hydrochloride; Tetramethylenediamine Dihydrochloride
IUPAC Name
butane-1,4-diamine;dihydrochloride
SMILES
C(CCN)CN.Cl.Cl
InChI
InChI=1S/C4H12N2.2ClH/c5-3-1-2-4-6;;/h1-6H2;2*1H
InChI Key
XXWCODXIQWIHQN-UHFFFAOYSA-N
Boiling Point
159 °C at 760 mmHg
Melting Point
>280 °C (dec.)
Purity
≥ 98 %
Density
1.472 g/cm3
Solubility
Slightly soluble in Water
Appearance
White to off-white solid
Application
Used in biochemical research.
Storage
Store at 2-8 °C under inert atmosphere
Refractive Index
1.6300 (estimate)
LogP
2.68860
Related CAS
110-60-1 (free base)
Safety Information
Hazards
H315:
Causes skin irritation.
H319:
Causes serious eye irritation.
Causes skin irritation.
H319:
Causes serious eye irritation.
Precautionary Statement
P264:
Wash thoroughly after handling.
P280:
Wear protective gloves/protective clothing/eye protection/face protection.
P302+P352:
IF ON SKIN:
Wash with plenty of soap and water.
P332+P313:
If skin irritation occurs:
Get medical advice/attention.
P337+P313:
If eye irritation persists:
Get medical advice/attention.
P362+P364:
Take off contaminated clothing. [As modified by IV ATP].
And wash it before reuse. [Added by IV ATP].
Wash thoroughly after handling.
P280:
Wear protective gloves/protective clothing/eye protection/face protection.
P302+P352:
IF ON SKIN:
Wash with plenty of soap and water.
P332+P313:
If skin irritation occurs:
Get medical advice/attention.
P337+P313:
If eye irritation persists:
Get medical advice/attention.
P362+P364:
Take off contaminated clothing. [As modified by IV ATP].
And wash it before reuse. [Added by IV ATP].
Signal Word
Warning
Computed Properties
Hydrogen Bond Donor Count
4
Hydrogen Bond Acceptor Count
2
Rotatable Bond Count
3
Exact Mass
160.0534038 g/mol
Monoisotopic Mass
160.0534038 g/mol
Topological Polar Surface Area
52Ų
Heavy Atom Count
8
Formal Charge
0
Complexity
17.5
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
3
Compound Is Canonicalized
Yes
Patents
| Publication Number | Title | Priority Date |
|---|---|---|
| CN-113897187-A | Polymer clean drilling fluid system | 2021-11-27 |
| CN-113519506-A | Protein-free and DMSO-free cell cryopreservation liquid, application and preparation method thereof | 2021-09-07 |
| CN-113519506-B | Protein-free and DMSO-free cell cryopreservation liquid, application and preparation method thereof | 2021-09-07 |
| CN-113528441-A | Rapid and efficient clinical-grade pigment epithelial cell induction method, kit and application | 2021-08-05 |
| CN-113647416-A | Preparation method of multi-connection nutrient polymerization gel, product and application of multi-connection nutrient polymerization gel in crops | 2021-08-05 |
| CN-113388576-A | Rat vascular smooth muscle cell culture medium and application thereof | 2021-07-12 |
| CN-113337459-A | Method for improving differentiation efficiency of pluripotent stem cells | 2021-06-02 |
| CN-113215095-A | Compositions, media supplements, and stem cell media and methods of culture | 2021-05-26 |
| CN-113061584-A | Culture medium additive capable of promoting growth of adenovirus | 2021-05-14 |
| CN-113068615-A | In-vitro regeneration method of litchi, product and application thereof | 2021-05-12 |
Literatures
| PMID | Publication Date | Title | Journal |
|---|---|---|---|
| 23571415 | 2013-06-01 | Structure-based identification of OATP1B1/3 inhibitors | Molecular pharmacology |
| 20925391 | 2010-11-11 | Targeting the polyamine transport system with benzazepine- and azepine-polyamine conjugates | Journal of medicinal chemistry |
| 4650 | 1976-02-01 | A differential scanning calorimetric study of conversion of ovalbumin to S-ovalbumin in eggs | Journal of the science of food and agriculture |
