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1,3-Adamantanediacetic acid

Catalog Number
17768-28-4
CAS
17768-28-4
Synonyms
[3-(CARBOXYMETHYL)-1-ADAMANTYL]ACETIC ACID; AKOS BC-0491; 1,3-BIS(CARBOXYMETHYL)ADAMANTANE; 1,3-ADAMANTANEDIACETIC ACID; 2-[3-(carboxymethyl)-1-adamantyl]acetic acid; IFLAB-BB F0020-1575
Molecular Weight
252.31
Molecular Formula
C14H20O4
Chemical structural formula

Product Information

Purity
N/A
MDL
MFCD00191708
Appearance
White to Light yellow powder to crystal
Storage
Store under inert gas
Boiling Point
453.9ºC at 760 mmHg
Melting Point
234-237ºC(lit.)
Density
1.304 g/cm3

Safety Information

Signal Word
Warning
Precautionary Statement
P264 : Wash skin thoroughly after handling.P280 : Wear protective gloves/ eye protection/ face protection.P337 + P313 : If eye irritation persists: Get medical advice/ attention.P305 + P351 + P338 : IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.P302 + P352 : IF ON SKIN: Wash with plenty of soap and water.P332 + P313 : If skin irritation occurs: Get medical advice/ attention.P362 : Take off contaminated clothing and wash before reuse.
Hazard Statements
H315 : Causes skin irritation.H319 : Causes serious eye irritation.
WGK Germany
3
Canonical SMILES
C1C2CC3(CC1CC(C2)(C3)CC(=O)O)CC(=O)O
InChI
InChI=1S/C14H20O4/c15-11(16)6-13-2-9-1-10(4-13)5-14(3-9,8-13)7-12(17)18/h9-10H,1-8H2,(H,15,16)(H,17,18)
InChI Key
UTENGZNBNPABQE-UHFFFAOYSA-N