1,3-Cyclohexanebis(methylamine)

Product Information

Molecular Formula:
C8H18N2
Molecular Weight:
142.24
Description
1,3-Cyclohexanebis(methylamine), mixture of isomers (1,3-BAC), is used as a cross-linking agent that can be used in the formation of fiber-based membranes for the separation of CO2. It can also be used in the synthesis of open-framework bimetallic phosphites for potential usage in molecular sieves and ion exchangers.
Synonyms
1,3-bis(aminomethyl)-cyclohexan; 1,3-Cyclohexanedimethanamine; cyclohexanedimethanamine; kodaksilverhalidesolvenths-103; 1,3-DI(AMINOMETHYL)CYCLOHEXANE; 1,3-CYCLOHEXANEBIS(METHYLAMINE)
IUPAC Name
[3-(aminomethyl)cyclohexyl]methanamine
Canonical SMILES
C1CC(CC(C1)CN)CN
InChI
InChI=1S/C8H18N2/c9-5-7-2-1-3-8(4-7)6-10/h7-8H,1-6,9-10H2
InChI Key
QLBRROYTTDFLDX-UHFFFAOYSA-N
Boiling Point
220 °C
Melting Point
-70 °C
Flash Point
113 °C
Purity
95%
Density
0.945
Appearance
CLEAR COLORLESS LIQUID
Refractive Index
n20/D 1.493 (lit.)

Safety Information

Hazards
H302+H312:
Harmful if swallowed.
Harmful in contact with skin.
H314:
Causes severe skin burns and eye damage.
H371:
May cause damage to organs.
H412:
Harmful to aquatic life with long-lasting effects.
Precautionary Statement
P260:
Do not breathe dust, fumes, gas, mist, vapours, spray.
P273:
Avoid release to the environment.
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.

Computed Properties

XLogP3
0.2
Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
2
Rotatable Bond Count
2
Exact Mass
142.146998583 g/mol
Monoisotopic Mass
142.146998583 g/mol
Topological Polar Surface Area
52Ų
Heavy Atom Count
10
Formal Charge
0
Complexity
83.3
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
2
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-114133878-A Low-temperature fast curing composition and preparation method and application thereof 2021-12-15
CN-114058008-A Process for preparing semi-aromatic polyamides end-capped with monocarboxylic acids, semi-aromatic polyamides and molding compositions 2021-12-13
CN-114058009-A Process for preparing semi-aromatic polyamides with reduced loss of diamine monomer, semi-aromatic polyamides and molding compositions 2021-12-13
CN-114058010-A Process for preparing low-energy semiaromatic polyamides, semiaromatic polyamides and moulding compositions 2021-12-13
CN-114133559-A Process for preparing semiaromatic polyamides with reduced salt formation cycle, semiaromatic polyamides and moulding compositions 2021-12-13
CN-114085492-A Resin composition, prepreg and laminated board thereof 2021-12-07
CN-114160127-A Amine-loss-preventing hydrogenation catalyst, and preparation method and application thereof 2021-12-01
CN-114163334-A Modified alicyclic amine curing agent and preparation method thereof 2021-11-18
CN-114031748-A Low-viscosity water-based epoxy curing agent and preparation method thereof 2021-11-15
JP-2022009148-A Laminated tube 2021-10-14

Literatures

PMID Publication Date Title Journal
22069710 2011-03-01 Mechanism of diphtheria toxin catalytic domain delivery to the eukaryotic cell cytosol and the cellular factors that directly participate in the process Toxins
18177036 2008-02-04 Doping-induced structure variation of 1,3-cyclohexane- bis(methylamine)-templated zinc-phosphorus open structures Inorganic chemistry
12007788 2002-04-03 Retrograde transport of protein toxins under conditions of COPI dysfunction Biochimica et biophysica acta
11210556 2001-01-01 Use of aminoglycoside antibiotics and related compounds to study ADP-ribosylation factor (ARF)/coatomer function in Golgi traffic Methods in enzymology
The molarity calculator equation

Mass (g) = Concentration (mol/L) × Volume (L) × Molecular Weight (g/mol)

The dilution calculator equation

Concentration (start) × Volume (start) = Concentration (final) × Volume (final)

This equation is commonly abbreviated as: C1V1 = C2V2

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