Tamoxifen Citrate | CAS No. 54965-24-1

Tamoxifen Citrate

Basic Information

CAS Number

54965-24-1

Molecular Formula

C32H37NO8

Molecular Weight

563.6 g/mol

AD

Basic Physical Properties

Melting Point

140-144 ºC

Boiling Point

No data available

Flash Point

No data available

Solubility

methanol: soluble50mg/mL, clear, colorless

Vapor Pressure

No data available

CCC(=C(C1=CC=CC=C1)C2=CC=C(C=C2)OCCN(C)C)C3=CC=CC=C3.C(C(=O)O)C(CC(=O)O)(C(=O)O)O

InChI

InChI=1S/C26H29NO.C6H8O7/c1-4-25(21-11-7-5-8-12-21)26(22-13-9-6-10-14-22)23-15-17-24(18-16-23)28-20-19-27(2)3;7-3(8)1-6(13,5(11)12)2-4(9)10/h5-18H,4,19-20H2,1-3H3;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)/b26-25-;

InChIKey

FQZYTYWMLGAPFJ-OQKDUQJOSA-N

LogP

4.747600000000004

Topological Polar Surface Area

144.60000000000002 Ų

Hydrogen Bond Donor/Acceptor

4 / 9

Complexity

690

Safety Information

View Safety Information

GHS Hazard Pictograms

H302H302
H350H350
H360H360

Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral
H350 May cause cancer
Carcinogenicity
H360 May damage fertility or the unborn child
Reproductive toxicity

Hazard Class

Class IRRITANT Class IRRITANT

Toxicity

LD50 in mice, rats (mg/kg): 200, 600 i.p.; 62.5, 62.5 i.v.; 3000-6000, 1200-2500 orally (Furr, Jordan)

Synonyms & References

English

  • Tamoxifen, citrate salt
  • NCGC00094450-02
  • {2-[4-(1,2-Diphenyl-1-buten-1-yl)phenoxy]ethyl}dimethylamine 2-hydroxy-1,2,3-propanetricarboxylate salt
  • HMS2092K17
  • EU-0101203
  • Tamoxifen citrate (JP17/USP)
  • TAMOXIFEN CITRATE [WHO-IP]
  • HMS2095M14
  • (Z)-2-[4-(1,2-Diphenyl-1-butenyl)phenoxy]-N,N-dimethylethanamine citrate
  • Caditam
  • Nolvadex (TN) (AstraZeneca)
  • Emblon
  • NCGC00016206-05
  • 2-[4-[(Z)-1,2-diphenylbut-1-enyl]phenoxy]-N,N-dimethylethanamine;2-hydroxypropane-1,2,3-tricarboxylic acid
  • Tamoxifen citrate salt
  • Q27108378
  • HY-13757
  • Prestwick_458
  • TAMOXIFEN CITRATE [JAN]
  • T 9262
  • Lopac-T-9262
  • BCP0726000223
  • Tox21_202070
  • Tox21_501203
  • 2-{4-[(1Z)-1,2-diphenylbut-1-en-1-yl]phenoxy}-N,N-dimethylethanamine 2-hydroxypropane-1,2,3-tricarboxylate (salt)
  • D00966
  • Z-Tamoxifen citrate
  • (z)-2-(4-(1,2-diphenyl-1-butenyl)phenoxy)-n,n-dimethylethanamine,citrate
  • GLXC-26314
  • NCGC00016206-03
  • Tafoxen

MDL Number

MFCD00058321

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