1,4-Cyclohexanedicarboxylic acid
Product Information
Molecular Formula
0
Molecular Weight
172.18
Description
1,4-Cyclohexanedicarboxylic acid (CAS# 1076-97-7) is used in preparation method of Polyester resin for metal coating.
Synonyms
0
IUPAC Name
cyclohexane-1,4-dicarboxylic acid
SMILES
0
InChI
0
InChI Key
0
Boiling Point
384.1 °C at 760 mmHg
Melting Point
165-168 °C
Flash Point
235°C
Purity
> 98.0 % (GC) (T)
Density
1.314 g/cm3
Appearance
White crystal
Storage
Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances.
Refractive Index
1.4450 (estimate)
Stability
Stable under normal temperatures and pressures.
LogP
0.96200
Vapor Pressure
0.0112mmHg at 25°C
Safety Information
Hazards
H315:
Causes skin irritation.
H319:
Causes serious eye irritation.
Causes skin irritation.
H319:
Causes serious eye irritation.
Precautionary Statement
P264, P270, P280, P301+P312, P305+P351+P338, P330, P337+P313, and P501
Signal Word
Warning
Computed Properties
XLogP3
0.5
Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
4
Rotatable Bond Count
2
Exact Mass
172.07355886 g/mol
Monoisotopic Mass
172.07355886 g/mol
Topological Polar Surface Area
74.6Ų
Heavy Atom Count
12
Formal Charge
0
Complexity
169
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 |
|---|---|---|
| JP-2022029172-A | Active ingredient release material, method of manufacturing active ingredient release material, method of release of active ingredient | 2020-08-04 |
| JP-2021177828-A | Dial-type racing system string | 2020-05-11 |
| JP-2021137697-A | Cyclic compound separation or purification methods, cyclic compound production methods, separators, and separators | 2020-03-02 |
| EP-3842470-A1 | Polyamide moulding compositions for hypochlorite resistant applications | 2019-12-23 |
| EP-3842496-A1 | Polyamide moulding compositions for hypochlorite resistant applications | 2019-12-23 |
| US-2021187361-A1 | Golf ball | 2019-12-23 |
| US-2021189124-A1 | Polyamide molding compounds for hypochlorite-resistant applications | 2019-12-23 |
| US-2021189125-A1 | Polyamide molding compounds for applications resistant to hypochlorite | 2019-12-23 |
| WO-2021123018-A1 | Soap composition | 2019-12-20 |
| WO-2021123144-A1 | Pro-perfume compositions | 2019-12-20 |
Literatures
| PMID | Publication Date | Title | Journal |
|---|---|---|---|
| 22945794 | 2012-10-21 | Incorporation of spin-5/2 chain into 2D network with conformational pure e,a-cis-cyclohexane-1,4-dicarboxylato linker | Dalton transactions (Cambridge, England : 2003) |
| 21422616 | 2011-04-01 | Seven hexamethylenetetramine (HMTA) complexes with mono- and dicarboxylic acids: analysis of packing modes of HMTA complexes in the literature | Acta crystallographica. Section B, Structural science |
| 21522256 | 2011-02-12 | Bis(μ-cyclo-hexane-1,4-dicarboxyl-ato)bis-{aqua-[1-(1H-imidazo[4,5-f][1,10]phenanthrolin-2-yl)naphthalen-2-ol]cadmium} monohydrate | Acta crystallographica. Section E, Structure reports online |
| 20826823 | 2010-11-12 | The N domain of human angiotensin-I-converting enzyme: the role of N-glycosylation and the crystal structure in complex with an N domain-specific phosphinic inhibitor, RXP407 | The Journal of biological chemistry |
| 21580265 | 2010-02-24 | Poly[[μ(2)-1,2-bis-(imidazol-1-ylmeth-yl)benzene](μ(2)-cyclo-hexane-1,4-dicarboxyl-ato)cobalt(II)] | Acta crystallographica. Section E, Structure reports online |
| 21579917 | 2009-12-04 | Poly[tetra-kis(μ-cyclo-hexa-ne-1,4-di-carboxyl-ato)di-μ-hydroxido-penta-zinc(II)] | Acta crystallographica. Section E, Structure reports online |
| 21577703 | 2009-09-05 | Poly[[μ(2)-1,4-bis-(imidazol-1-ylmeth-yl)benzene]bis-(μ(4)-cyclo-hexane-1,4-dicarboxyl-ato)dicobalt(II)] | Acta crystallographica. Section E, Structure reports online |
| 19652299 | 2009-08-01 | Poly[diaqua[mu-1,4-bis(imidazol-1-ylmethyl)benzene-kappa2N3:N3'](mu-trans-cyclohexane-1,4-carboxylato-kappa2O1:O4)manganese(II)]: a three-dimensional hydrogen-bonding alpha-polonium net | Acta crystallographica. Section C, Crystal structure communications |
| 21583309 | 2009-07-31 | Poly[[μ-1,4-bis-(imidazol-1-ylmeth-yl)benzene]bis-(μ(4)-cyclo-hexane-1,4-dicarboxyl-ato)dinickel(II)] | Acta crystallographica. Section E, Structure reports online |
| 21582692 | 2009-06-10 | catena-Poly[[bis-(4-carboxy-cyclo-hexane-carboxyl-ato-κO,O)cadmium(II)]-μ-1,4-bis-(imidazol-1-ylmeth-yl)benzene-κN:N] | Acta crystallographica. Section E, Structure reports online |
