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Details

Stereochemistry RACEMIC
Molecular Formula C16H31NO2.C6H8O7
Molecular Weight 461.5464
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of HEXETYLAMINE CITRATE

SMILES

OC(=O)CC(O)(CC(O)=O)C(O)=O.CCC(C1CCCCC1)C(=O)OCCN(CC)CC

InChI

InChIKey=FSDBTUMIKFVKQC-UHFFFAOYSA-N
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)

HIDE SMILES / InChI

Approval Year

Name Type Language
HEXETYLAMINE CITRATE
WHO-DD  
Common Name English
CYCLOHEXANEACETIC ACID, .ALPHA.-ETHYL-, 2-(DIETHYLAMINO)ETHYL ESTER, 2-HYDROXY-1,2,3-PROPANETRICARBOXYLATE (1:1)
Systematic Name English
CYCLOHEXANEACETIC ACID, .ALPHA.-ETHYL-, 2-(DIETHYLAMINO)ETHYL ESTER CITRATE (1:1)
Common Name English
BUTYRIC ACID, 2-CYCLOHEXYL-, 2-(DIETHYLAMINO)ETHYL ESTER, CITRATE (1:1)
Common Name English
Hexetylamine citrate [WHO-DD]
Common Name English
NSC-81271
Code English
Code System Code Type Description
PUBCHEM
203507
Created by admin on Sat Dec 16 08:31:40 GMT 2023 , Edited by admin on Sat Dec 16 08:31:40 GMT 2023
PRIMARY
FDA UNII
6G6IZ5GV2R
Created by admin on Sat Dec 16 08:31:40 GMT 2023 , Edited by admin on Sat Dec 16 08:31:40 GMT 2023
PRIMARY
EVMPD
SUB14101MIG
Created by admin on Sat Dec 16 08:31:40 GMT 2023 , Edited by admin on Sat Dec 16 08:31:40 GMT 2023
PRIMARY
NSC
81271
Created by admin on Sat Dec 16 08:31:40 GMT 2023 , Edited by admin on Sat Dec 16 08:31:40 GMT 2023
PRIMARY
SMS_ID
100000077922
Created by admin on Sat Dec 16 08:31:40 GMT 2023 , Edited by admin on Sat Dec 16 08:31:40 GMT 2023
PRIMARY
CAS
14601-95-7
Created by admin on Sat Dec 16 08:31:40 GMT 2023 , Edited by admin on Sat Dec 16 08:31:40 GMT 2023
PRIMARY