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

Details

Stereochemistry RACEMIC
Molecular Formula C10H14FNO
Molecular Weight 183.2227
Optical Activity ( + / - )
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-FLUORORACEPHEDRINE

SMILES

CN[C@H](C)[C@@H](O)C1=CC=C(F)C=C1

InChI

InChIKey=SPEQHEOLWDGWML-GMSGAONNSA-N
InChI=1S/C10H14FNO/c1-7(12-2)10(13)8-3-5-9(11)6-4-8/h3-7,10,12-13H,1-2H3/t7-,10-/m1/s1

HIDE SMILES / InChI

Molecular Formula C10H14FNO
Molecular Weight 183.2227
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 10:36:47 GMT 2023
Edited
by admin
on Sat Dec 16 10:36:47 GMT 2023
Record UNII
FUH6UKV9U8
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-FLUORORACEPHEDRINE
Common Name English
1-(4-FLUOROPHENYL)-2-(METHYLAMINO)PROPAN-1-OL
Systematic Name English
BENZENEMETHANOL, 4-FLUORO-.ALPHA.-(1-(METHYLAMINO)ETHYL)-
Systematic Name English
BENZYL ALCOHOL, P-FLUORO-.ALPHA.-(1-(METHYLAMINO)ETHYL)-
Common Name English
BENZENEMETHANOL, 4-FLUORO-.ALPHA.-(1-(METHYLAMINO)ETHYL)-, (R*,S*)-
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID401024289
Created by admin on Sat Dec 16 10:36:47 GMT 2023 , Edited by admin on Sat Dec 16 10:36:47 GMT 2023
PRIMARY
FDA UNII
FUH6UKV9U8
Created by admin on Sat Dec 16 10:36:47 GMT 2023 , Edited by admin on Sat Dec 16 10:36:47 GMT 2023
PRIMARY
CAS
2711-62-8
Created by admin on Sat Dec 16 10:36:47 GMT 2023 , Edited by admin on Sat Dec 16 10:36:47 GMT 2023
NON-SPECIFIC STEREOCHEMISTRY
CAS
63009-92-7
Created by admin on Sat Dec 16 10:36:47 GMT 2023 , Edited by admin on Sat Dec 16 10:36:47 GMT 2023
PRIMARY
PUBCHEM
95436263
Created by admin on Sat Dec 16 10:36:47 GMT 2023 , Edited by admin on Sat Dec 16 10:36:47 GMT 2023
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT