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Details

Stereochemistry ABSOLUTE
Molecular Formula C12H15N
Molecular Weight 173.2542
Optical Activity ( - )
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BICIFADINE, (-)-

SMILES

[H][C@@]12C[C@@]1(CNC2)C3=CC=C(C)C=C3

InChI

InChIKey=OFYVIGTWSQPCLF-NWDGAFQWSA-N
InChI=1S/C12H15N/c1-9-2-4-10(5-3-9)12-6-11(12)7-13-8-12/h2-5,11,13H,6-8H2,1H3/t11-,12+/m0/s1

HIDE SMILES / InChI

Molecular Formula C12H15N
Molecular Weight 173.2542
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 14:56:13 UTC 2023
Edited
by admin
on Sat Dec 16 14:56:13 UTC 2023
Record UNII
5P6PXH4ZEK
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BICIFADINE, (-)-
Common Name English
(-)-BICIFADINE
Common Name English
(1S,5R)-1-(4-METHYLPHENYL)-3-AZABICYCLO(3.1.0)HEXANE
Systematic Name English
3-AZABICYCLO(3.1.0)HEXANE, 1-(4-METHYLPHENYL)-, (1S,5R)-
Systematic Name English
BICIFADINE, (1S,5R)-(-)-
Common Name English
(1S,5R)-(-)-1-P-TOLYL-3-AZABICYCLO(3.1.0)HEXANE
Systematic Name English
Code System Code Type Description
PUBCHEM
11715257
Created by admin on Sat Dec 16 14:56:13 UTC 2023 , Edited by admin on Sat Dec 16 14:56:13 UTC 2023
PRIMARY
FDA UNII
5P6PXH4ZEK
Created by admin on Sat Dec 16 14:56:13 UTC 2023 , Edited by admin on Sat Dec 16 14:56:13 UTC 2023
PRIMARY
EPA CompTox
DTXSID70471021
Created by admin on Sat Dec 16 14:56:13 UTC 2023 , Edited by admin on Sat Dec 16 14:56:13 UTC 2023
PRIMARY
CAS
83213-67-6
Created by admin on Sat Dec 16 14:56:13 UTC 2023 , Edited by admin on Sat Dec 16 14:56:13 UTC 2023
PRIMARY
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RACEMATE -> ENANTIOMER