Cyclohexaneacetic acid, α-ethyl-, 2-(diethylamino)ethyl ester, 2-hydroxy-1,2,3-propanetricarboxylate (1:1)
CAS Registry Number®
14601-95-7
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CAS Name
Cyclohexaneacetic acid, α-ethyl-, 2-(diethylamino)ethyl ester, 2-hydroxy-1,2,3-propanetricarboxylate (1:1)Molecular Formula
C16H31NO2.C6H8O7Cite this Page
Cyclohexaneacetic acid, α-ethyl-, 2-(diethylamino)ethyl ester, 2-hydroxy-1,2,3-propanetricarboxylate (1:1). CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=14601-95-7 (retrieved ) (CAS RN: 14601-95-7). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C16H31NO2.C6H8O7/c1-4-15(14-10-8-7-9-11-14)16(18)19-13-12-17(5-2)6-3;7-3(8)1-6(13,5(11)12)2-4(9)10/h14-15H,4-13H2,1-3H3;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)
InChIKey
InChIKey=FSDBTUMIKFVKQC-UHFFFAOYSA-N
SMILES
C(C(OCCN(CC)CC)=O)(CC)C1CCCCC1.C(CC(O)=O)(CC(O)=O)(C(O)=O)O
Canonical SMILES
O=C(O)CC(O)(C(=O)O)CC(=O)O.O=C(OCCN(CC)CC)C(CC)C1CCCCC1
Other Names for this Substance
- Cyclohexaneacetic acid, α-ethyl-, 2-(diethylamino)ethyl ester, 2-hydroxy-1,2,3-propanetricarboxylate (1:1)
- Cyclohexaneacetic acid, α-ethyl-, 2-(diethylamino)ethyl ester citrate (1:1)
- Butyric acid, 2-cyclohexyl-, 2-(diethylamino)ethyl ester, citrate (1:1)
- Hexetylamine citrate
- NSC 81271
