Pentetic acid
Properties
- Molecular formula
- C14H23N3O10
- Molar mass
- 393.35 g/mol
- Exact mass
- 393.1383 Da
- Melting point
- 219 °C
- logP
- -2.68Crippen estimate
- Polar surface area
- 196.2 Ų
- H-bond donors / acceptors
- 5 / 8
- Rotatable bonds
- 16
Hazards
Danger
- H319 Causes serious eye irritationSerious eye damage/eye irritation
- H332 Harmful if inhaledAcute toxicity, inhalation
- H360D May damage the unborn childReproductive toxicity
- H373 May causes damage to organs through prolonged or repeated exposureSpecific target organ toxicity, repeated exposure
Harmonised EU classification (CLP Annex VI, index 607-735-00-1), via PubChem.
Precautionary statements
P203, P260, P261, P264+P265, P271, P280, P304+P340, P305+P351+P338, P317, P318, P319, P337+P317, P405, P501
Identifiers
CAS number
67-43-6SMILES
O=C(O)CN(CCN(CC(=O)O)CC(=O)O)CCN(CC(=O)O)CC(=O)OInChIKey
QPCDCPDFJACHGM-UHFFFAOYSA-NInChI
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)Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
33 names · show all
- Glycine, N,N-bis[2-[bis(carboxymethyl)amino]ethyl]-
- N,N-Bis[2-[bis(carboxymethyl)amino]ethyl]glycine
- [[(Carboxymethyl)imino]bis(ethylenenitrilo)]tetraacetic acid
- Chel 330 acid
- 1,1,4,7,7-Diethylenetriaminepentaacetic acid
- Monaquest CAI
- 3,6,9-Triazaundecanedioic acid, 3,6,9-tris(carboxymethyl)-
- Acetic acid, 2,2′,2′′,2′′′-[[(carboxymethyl)imino]bis(2,1-ethanediylnitrilo)]tetrakis-
- Diethylenetriamine-N,N,N′,N′′,N′′-pentaacetic acid
- DTPA
- DETPA
- Pentacarboxymethyl diethylenetriamine
- Detarex
- Diethylenetriaminepentaacetic acid
- Hamp-ex acid
- Complexon V
- Dabeersen 503
- DETP
- Detapac
- DPTA
- Titriplex V
- Clewat DA
- Chel DTPA
- Dissolvine D
- NSC 7340
- 25: PN: WO2013046163 PAGE: 13 claimed sequence
- Trilon CS
- Chelest 3PA
- Chelest PA
- [(2-[[2-(Bis-carboxymethyl-amino)-ethyl]-carboxymethyl-amino]-ethyl)-carboxymethyl-amino]-acetic acid
- 2-[Bis[2-[bis(carboxymethyl)amino]ethyl]amino]acetic acid
- Chelest PA-SD
- D 1
Work with Pentetic acid
Stereoisomers, salts and isotopologues
The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.
Similar compounds
Triethylenetetraminehexaacetic acid869-52-3100 % similar
Ethylenediaminetetraacetic acid60-00-494 % similar
Dota (chelator)60239-18-194 % similar
Diammonium EDTA20824-56-081 % similar
Hydroxyethylethylenediaminetriacetic acid150-39-078 % similar
PDTA1939-36-276 % similar
Nitrilotriacetic acid139-13-974 % similar
Hexamethylenediaminetetraacetic acid1633-00-773 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.