ChemicalBook--->CAS DataBase List--->67-43-6

67-43-6

67-43-6 Structure

67-43-6 Structure
IdentificationMore
[Name]

Diethylenetriaminepentaacetic acid
[CAS]

67-43-6
[Synonyms]

(CARBOXYMETHYLIMINO)BIS(ETHYLENEDINITRILO)TETRAACETIC ACID
(CARBOXYMETHYLIMINO)BIS(ETHYLENENITRILO)TETRAACETIC ACID
COMPLEXONE V(R)
DETAPAC
DIETHYLENETRIAMINE-N,N,N',N'',N''-PENTAACETIC ACID
DIETHYLENETRIAMINEPENTAACETIC ACID
DIETHYLENETRIAMINEPENTACETIC ACID
(DIETHYLENETRINITRILO)PENTAACETIC ACID
DIPA
DTPA
DTRA
HAMPEX ACID
IDRANAL(R) V
LABOTEST-BB LT00452993
N,N-BIS(2-[BIS(CARBOXYMETHYL)AMINO]ETHYL)GLYCINE
PENTA(CARBOXYMETHYL)DIETHYLENETRIAMINE
PENTETIC ACID
TIMTEC-BB SBB008753
TITRIPLEX(R) V
TITRIPLEX(R) VS
[EINECS(EC#)]

200-652-8
[Molecular Formula]

C14H23N3O10
[MDL Number]

MFCD00004289
[Molecular Weight]

393.35
[MOL File]

67-43-6.mol
Chemical PropertiesBack Directory
[Appearance]

solid
[Melting point ]

219-220 °C (lit.)
[Boiling point ]

517.84°C (rough estimate)
[bulk density]

580kg/m3
[density ]

1.56
[refractive index ]

1.5700 (estimate)
[Fp ]

200 °C
[storage temp. ]

room temp
[solubility ]

0.1 M NaOH: 0.1 M at 20 °C, clear, colorless
[form ]

Crystalline Powder
[pka]

pK1:;pK2:2.55(+1);pK3:4.33(+2);pK4:8.60(-3);pK5,10.58 (25°C)
[color ]

White to almost white
[PH]

2-3 (H2O, 20℃)(saturated solution)
[Stability:]

Stable. Incompatible with strong oxidizing agents.
[biological source]

synthetic (organic)
[Water Solubility ]

5 g/L (20 ºC)
[Merck ]

14,7125
[BRN ]

1810219
[Cosmetics Ingredients Functions]

CHELATING
[InChI]

1S/C14H23N3O10/c18-10(19)5-15(1-3-16(6-11(20)21)7-12(22)23)2-4-17(8-13(24)25)9-14(26)27/h1-9H2,(H,18,19)(H,20,21)(H,22,23)(H,24,25)(H,26,27)
[InChIKey]

QPCDCPDFJACHGM-UHFFFAOYSA-N
[SMILES]

OC(=O)CN(CCN(CC(O)=O)CC(O)=O)CCN(CC(O)=O)CC(O)=O
[LogP]

-1.361 (est)
[CAS DataBase Reference]

67-43-6(CAS DataBase Reference)
[NIST Chemistry Reference]

N,N-Bis(2-(bis-(carboxymethyl)amino)ethyl)-glycine(67-43-6)
[EPA Substance Registry System]

67-43-6(EPA Substance)
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)Health Hazard (GHS08)
GHS07,GHS08
[Signal word ]

Warning
[Hazard statements ]

H319-H332-H361fd-H373
[Precautionary statements ]

P201-P202-P260-P304+P340+P312-P305+P351+P338-P308+P313
[Hazard Codes ]

Xi,N
[Risk Statements ]

R36:Irritating to the eyes.
R51/53:Toxic to aquatic organisms, may cause long-term adverse effects in the aquatic environment .
R36/37/38:Irritating to eyes, respiratory system and skin .
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36:Wear suitable protective clothing .
S61:Avoid release to the environment. Refer to special instructions safety data sheet .
S37/39:Wear suitable gloves and eye/face protection .
[RIDADR ]

UN 3077 9/PG 3
[WGK Germany ]

2
[RTECS ]

MB8205000
[F ]

3
[TSCA ]

Yes
[REACH Registrations]

Active
[HazardClass ]

9
[PackingGroup ]

III
[HS Code ]

29224995
[Storage Class]

6.1C - Combustible acute toxic Cat.3
toxic compounds or compounds which causing chronic effects
[Hazard Classifications]

Acute Tox. 4 Inhalation
Eye Irrit. 2
Repr. 1B
STOT RE 2 Inhalation
[Safety Profile]

Moderately toxic by intraperitoneal route. When heated to decomposition it emits toxic fumes of NOx.
[Toxicity]

LD50 orally in Rabbit: > 2000 mg/kg
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Hydrochloric acid-->Formaldehyde-->Sodium cyanide-->Diethylenetriamine
[Preparation Products]

DIETHYLENETRIAMINEPENTAACETIC DIANHYDRIDE-->Diethylenetriaminepenta(methylene-phosphonic acid)
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

Diethylenetriaminepentaacetic acid(67-43-6).msds
Hazard InformationBack Directory
[Chemical Properties]

Diethylenetriaminepentaacetic acid is a solid.
[Chemical Properties]

Pentetic acid occurs as a white crystalline solid and is almost odorless.
[Chemical Properties]

solid
[Uses]

chelating agent, diagnostic aid
[Uses]

Diethylenetriaminepentaacetic Acid is a component of manganese and zinc fertilizers.
[Definition]

ChEBI: Pentetic acid is a pentacarboxylic acid. It has a role as a copper chelator. It is a conjugate acid of a pentetate(1-).
[Production Methods]

Pentetic acid is a pentaacetic acid triamine formed during the preparation of the amino carboxylic acid and its salt.
[General Description]

Visit our Titration Center to learn more.
[reaction suitability]

reaction type: Complexometric reactions
[Pharmaceutical Applications]

Pentetic acid is mainly used as a chelating agent in the preparation of imaging and contrast agents for radionuclide and magnetic resonance imaging.It is also used as a carrier excipient for neutron-capture isotopes in, for example, radiotherapy.Pentetic acid–isotope complexes have also been considered as model active substances in scintigraphic imaging studies.Pentetic acid has been used to chelate metal ions to reduce formation of reactive oxygen species during lyophilization.
[Safety]

Pentetic acid is used in intrathecal and intravenous injection preparations. The pure form of pentetic acid is moderately toxic by the intraperitoneal route.
LD50 (mouse, IP): 0.54 g/kg
LD50 (mouse, oral): 4.84 g/kg
[storage]

The activity of pentetic acid as a chelating agent may cause unwanted effects in formulations containing metal ions. The desired chelate may be displaced by other ions from the formulation.
[Purification Methods]

Crystallise DTPA from water. Dry under vacuum or at 110o. [Bielski & Thomas J Am Chem Soc 109 7761 1987, NMR: Wenzel et al. Anal Chem 54 615 1982, Beilstein 4 IV 2454.]
[Incompatibilities]

The activity of pentetic acid as a chelating agent may cause unwanted effects in formulations containing metal ions. The desired chelate may be displaced by other ions from the formulation.
[Regulatory Status]

Included in the FDA Inactive Ingredients Database (intrathecal and intravenous injections). Included in intravenous and intra-articular injections licensed in the UK.
Spectrum DetailBack Directory
[Spectrum Detail]

Diethylenetriaminepentaacetic acid(67-43-6)1HNMR
Diethylenetriaminepentaacetic acid(67-43-6)13CNMR
Diethylenetriaminepentaacetic acid(67-43-6)IR1
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

Diethylenetriaminepentaacetic acid, 98+%(67-43-6)
[Alfa Aesar]

Diethylenetriaminepentaacetic acid, 98+%(67-43-6)
[Sigma Aldrich]

67-43-6(sigmaaldrich)
[TCI AMERICA]

Diethylenetriaminepentaacetic Acid,>98.0%(T)(67-43-6)
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