U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry RACEMIC
Molecular Formula C13H17NO.ClH
Molecular Weight 239.741
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 6-EAPB HYDROCHLORIDE

SMILES

Cl.CCNC(C)CC1=CC2=C(C=CO2)C=C1

InChI

InChIKey=MUFUSNCKTVRMLR-UHFFFAOYSA-N
InChI=1S/C13H17NO.ClH/c1-3-14-10(2)8-11-4-5-12-6-7-15-13(12)9-11;/h4-7,9-10,14H,3,8H2,1-2H3;1H

HIDE SMILES / InChI

Molecular Formula C13H17NO
Molecular Weight 203.2802
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

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

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 10:36:48 GMT 2023
Edited
by admin
on Sat Dec 16 10:36:48 GMT 2023
Record UNII
86GLU89Z3S
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
6-EAPB HYDROCHLORIDE
Common Name English
6-BENZOFURANETHANAMINE, N-ETHYL-.ALPHA.-METHYL-, HYDROCHLORIDE (1:1)
Systematic Name English
Code System Code Type Description
CAS
1823318-37-1
Created by admin on Sat Dec 16 10:36:49 GMT 2023 , Edited by admin on Sat Dec 16 10:36:49 GMT 2023
PRIMARY
PUBCHEM
129318263
Created by admin on Sat Dec 16 10:36:49 GMT 2023 , Edited by admin on Sat Dec 16 10:36:49 GMT 2023
PRIMARY
FDA UNII
86GLU89Z3S
Created by admin on Sat Dec 16 10:36:49 GMT 2023 , Edited by admin on Sat Dec 16 10:36:49 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE
Related Record Type Details
ACTIVE MOIETY