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Details

Stereochemistry ACHIRAL
Molecular Formula C8H15NO2.ClH
Molecular Weight 193.671
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of Ethyl (2E)-4-(dimethylamino)-2-butenoate hydrochloride

SMILES

Cl.CCOC(=O)\C=C\CN(C)C

InChI

InChIKey=ZNMPTBLKKYPKMP-IPZCTEOASA-N
InChI=1S/C8H15NO2.ClH/c1-4-11-8(10)6-5-7-9(2)3;/h5-6H,4,7H2,1-3H3;1H/b6-5+;

HIDE SMILES / InChI

Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C8H15NO2
Molecular Weight 157.2102
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 19:13:06 GMT 2023
Edited
by admin
on Sat Dec 16 19:13:06 GMT 2023
Record UNII
A6GR9RT3TC
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Ethyl (2E)-4-(dimethylamino)-2-butenoate hydrochloride
Systematic Name English
2-Butenoic acid, 4-(dimethylamino)-, ethyl ester, hydrochloride (1:1), (2E)-
Systematic Name English
(E)-Ethyl 4-(dimethylamino)but-2-enoate hydrochloride
Systematic Name English
Code System Code Type Description
CAS
1255078-56-8
Created by admin on Sat Dec 16 19:13:06 GMT 2023 , Edited by admin on Sat Dec 16 19:13:06 GMT 2023
PRIMARY
FDA UNII
A6GR9RT3TC
Created by admin on Sat Dec 16 19:13:06 GMT 2023 , Edited by admin on Sat Dec 16 19:13:06 GMT 2023
PRIMARY
PUBCHEM
86662505
Created by admin on Sat Dec 16 19:13:06 GMT 2023 , Edited by admin on Sat Dec 16 19:13:06 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE