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Details

Stereochemistry ABSOLUTE
Molecular Formula C26H30Cl2F3NO
Molecular Weight 500.424
Optical Activity ( - )
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of HALOFANTRINE, (S)-

SMILES

CCCCN(CCCC)CC[C@H](O)C1=CC2=C(C=C(Cl)C=C2Cl)C3=CC(=CC=C13)C(F)(F)F

InChI

InChIKey=FOHHNHSLJDZUGQ-VWLOTQADSA-N
InChI=1S/C26H30Cl2F3NO/c1-3-5-10-32(11-6-4-2)12-9-25(33)23-16-22-21(14-18(27)15-24(22)28)20-13-17(26(29,30)31)7-8-19(20)23/h7-8,13-16,25,33H,3-6,9-12H2,1-2H3/t25-/m0/s1

HIDE SMILES / InChI

Molecular Formula C26H30Cl2F3NO
Molecular Weight 500.424
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 Mon Mar 31 23:14:21 GMT 2025
Edited
by admin
on Mon Mar 31 23:14:21 GMT 2025
Record UNII
R7ADS21FSN
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
L-WR-171669
Preferred Name English
HALOFANTRINE, (S)-
Common Name English
9-PHENANTHRENEMETHANOL, 1,3-DICHLORO-.ALPHA.-(2-(DIBUTYLAMINO)ETHYL)-6-(TRIFLUOROMETHYL)-, (-)-
Systematic Name English
HALOFANTRINE, (-)-
Common Name English
(-)-HALOFANTRINE
Common Name English
Code System Code Type Description
FDA UNII
R7ADS21FSN
Created by admin on Mon Mar 31 23:14:21 GMT 2025 , Edited by admin on Mon Mar 31 23:14:21 GMT 2025
PRIMARY
CAS
66051-76-1
Created by admin on Mon Mar 31 23:14:21 GMT 2025 , Edited by admin on Mon Mar 31 23:14:21 GMT 2025
PRIMARY
CAS
795297-28-8
Created by admin on Mon Mar 31 23:14:21 GMT 2025 , Edited by admin on Mon Mar 31 23:14:21 GMT 2025
ALTERNATIVE
PUBCHEM
72454
Created by admin on Mon Mar 31 23:14:21 GMT 2025 , Edited by admin on Mon Mar 31 23:14:21 GMT 2025
PRIMARY
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