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Details

Stereochemistry ABSOLUTE
Molecular Formula C15H20FNO4
Molecular Weight 297.322
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-((tert-Butoxycarbonyl)amino)-4-(3-fluorophenyl)butanoic acid, (R)-

SMILES

CC(C)(C)OC(=O)N[C@@H](CC(O)=O)CC1=CC(F)=CC=C1

InChI

InChIKey=ZKVPDNJRPDEQCZ-GFCCVEGCSA-N
InChI=1S/C15H20FNO4/c1-15(2,3)21-14(20)17-12(9-13(18)19)8-10-5-4-6-11(16)7-10/h4-7,12H,8-9H2,1-3H3,(H,17,20)(H,18,19)/t12-/m1/s1

HIDE SMILES / InChI

Molecular Formula C15H20FNO4
Molecular Weight 297.322
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 19:52:45 GMT 2025
Edited
by admin
on Wed Apr 02 19:52:45 GMT 2025
Record UNII
2Y7FG76R5B
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
(R)-3-((tert-Butoxycarbonyl)amino)-4-(3-fluorophenyl)butanoic acid
Preferred Name English
3-((tert-Butoxycarbonyl)amino)-4-(3-fluorophenyl)butanoic acid, (R)-
Systematic Name English
Benzenebutanoic acid, ?-[[(1,1-dimethylethoxy)carbonyl]amino]-3-fluoro-, (?R)-
Systematic Name English
Code System Code Type Description
FDA UNII
2Y7FG76R5B
Created by admin on Wed Apr 02 19:52:45 GMT 2025 , Edited by admin on Wed Apr 02 19:52:45 GMT 2025
PRIMARY
CAS
331763-66-7
Created by admin on Wed Apr 02 19:52:45 GMT 2025 , Edited by admin on Wed Apr 02 19:52:45 GMT 2025
PRIMARY
EPA CompTox
DTXSID90426578
Created by admin on Wed Apr 02 19:52:45 GMT 2025 , Edited by admin on Wed Apr 02 19:52:45 GMT 2025
PRIMARY
PUBCHEM
7009731
Created by admin on Wed Apr 02 19:52:45 GMT 2025 , Edited by admin on Wed Apr 02 19:52:45 GMT 2025
PRIMARY