13291-61-7

Name 1,2-Cyclohexylenedinitrilotetraacetic acid
CAS 13291-61-7
EINECS(EC#) 236-308-9
Molecular Formula C14H22N2O8
MDL Number MFCD00003845
Molecular Weight 346.33
MOL File 13291-61-7.mol
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Chemical Properties

Appearance white powder
Melting point  213-216 °C(lit.)
Boiling point  670.8±55.0 °C(Predicted)
density  1.48±0.1 g/cm3(Predicted)
vapor pressure  0Pa at 25℃
storage temp.  Sealed in dry,Room Temperature
form  Solid
pka 1.78±0.10(Predicted)
color  White to off-white
Stability: Stable. Incompatible with strong oxidizing agents. Combustible.
Water Solubility  425.4g/L at 25℃
InChI InChI=1/C14H22N2O8/c17-11(18)5-15(6-12(19)20)9-3-1-2-4-10(9)16(7-13(21)22)8-14(23)24/h9-10H,1-8H2,(H,17,18)(H,19,20)(H,21,22)(H,23,24)/t9-,10-/s3
InChIKey FCKYPQBAHLOOJQ-DPIMBTEZNA-N
SMILES N([C@@H]1CCCC[C@H]1N(CC(=O)O)CC(=O)O)(CC(=O)O)CC(=O)O |&1:1,6,r|
LogP -2.15 at 25℃
CAS DataBase Reference 13291-61-7(CAS DataBase Reference)
EPA Substance Registry System Glycine, N,N'-(1R,2R)-1,2-cyclohexanediylbis[N-(carboxymethyl)-, rel- (13291-61-7)

Safety Data

Symbol(GHS)  Exclamation Mark (GHS07)
GHS07
Signal word  Warning
Hazard statements  H302-H315-H319-H335
Precautionary statements  P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P305+P351+P338-P330-P332+P313-P337+P313-P362-P403+P233-P405-P501
Hazard Codes  Xi
Risk Statements 
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 .
S37/39:Wear suitable gloves and eye/face protection .
WGK Germany  3
F  9
TSCA  TSCA listed
REACH Registrations Active
HS Code  29224995

Hazard Information

Material Safety Data Sheet(MSDS)

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