Chemical identity

Fingolimod 2-Phenethyl Analog / Fingolimod ortho-Octylphenethyl Impurity

CAS 851039-25-3 · C35H57NO2

01Identity

Identifiers and names for this exact compound. Empty fields are left unassigned.

Lazychem IDLC-15278
PubChem CID11477977
NameFingolimod 2-Phenethyl Analog / Fingolimod ortho-Octylphenethyl Impurity
CAS RN851039-25-3
Molecular formulaC35H57NO2
Molecular weight523.83 g/mol
IUPAC name2-(2-(4-Octylphenethyl)-4-octylphenethyl)-2-aminopropane-1,3-diol
InChIKeyOJVJMONXMLQUEN-UHFFFAOYSA-N

02Structure identifiers

2D structurePubChem CID 11477977
2D structure: Fingolimod 2-Phenethyl Analog / Fingolimod ortho-Octylphenethyl Impurity, CAS 851039-25-3
Structure of Fingolimod 2-Phenethyl Analog / Fingolimod ortho-Octylphenethyl Impurity (CAS 851039-25-3). LazyChem record. Source identity: PubChem CID 11477977. Confirm the identifiers before analytical use.Download structure image

Structure facts for this exact identity.

Molecular formulaC35H57NO2
InChIKeyOJVJMONXMLQUEN-UHFFFAOYSA-N
Ring count2
Defined stereocentres0
Unassigned stereocentres0
SMILESCCCCCCCCC1=CC=C(C=C1)CCC2=C(C=CC(=C2)CCCCCCCC)CCC(CO)(CO)N
InChIInChI=1S/C35H57NO2/c1-3-5-7-9-11-13-15-30-17-19-31(20-18-30)21-24-34-27-32(16-14-12-10-8-6-4-2)22-23-33(34)25-26-35(36,28-37)29-38/h17-20,22-23,27,37-38H,3-16,21,24-26,28-29,36H2,1-2H3

03India status for this compound

These results apply only to this exact compound name and CAS number. Confirm the current official instruments before making a regulatory decision.

NDPS / RCSNOT FOUND IN REVIEWED ENTRIESCAS 851039-25-3 was not found in the reviewed exact-identity entries. Generic, class, analogue, salt and isomer provisions were not evaluated.
SCOMETNOT FOUND IN REVIEWED CAS ENTRIESCAS 851039-25-3 was not found in the reviewed exact-CAS mapping. Generic and analogue entries were not evaluated.

04Names and relationships

Associated parent compound

Fingolimod

View API and impurity family

Other names

  • 2-Phenethyl fingolimod analog
  • Fingolimod ortho-Octylphenethyl Impurity
  • 2-Amino-2-[4-octyl-2-(4-octylphenethyl)phenethyl]propane-1,3-diol
  • 2-(4-Octylphenethyl)-fingolimod
  • 2-amino-2-[2-[4-octyl-2-[2-(4-octylphenyl)ethyl]phenyl]ethyl]propane-1,3-diol
  • 2-(4-Octylphenethyl)-fingolimod Hydrochloride
  • Fingolimod EP Impurity E
  • 1,3-Propanediol, 2-amino-2-[2-[4-octyl-2-[2-(4-octylphenyl)ethyl]phenyl]ethyl]-
  • 2-Phenetyl fingolimod analog

Related records from the same parent family

05Documented history

Dated discovery, occurrence, use and issue claims are published only when a suitable primary or government source is available.

No dated history available

No verified discovery, first report, occurrence, use or issue event is currently available for this identity.

06Sources