Basic information
- CAS
7728-73-6- Standard SMILES
CCC(=C(c1ccccc1)c1ccc(OCCN(C)C)cc1)c1ccccc1- InChIKey
NKANXQFJJICGDU-UHFFFAOYSA-N- Molecular formula
- C26H29NO
- Average molar mass
- 371.5 g/mol
- Monoisotopic mass
- 371.22491455
Names & identifiers
- Preferred name
- (E,Z)-Tamoxifen
- IUPAC
- 2-[4-(1,2-diphenylbut-1-enyl)phenoxy]-N,N-dimethylethanamine
- English name
- (E/Z)-Tamoxifen
- Molecular formula
- C26H29NO
- Molecular weight
- 371.51
Names & synonyms
7728-73-6(E,Z)-TamoxifenRefChem:210459(E/Z)-Tamoxifen2-[4-(1,2-diphenylbut-1-enyl)phenoxy]-N,N-dimethylethanamineC26H29NO(Z)-1-(p-Dimethylaminoethoxyphenyl)-1,2-diphenyl-1-buteneSpectrum_001028Prestwick0_000146Prestwick1_000146Spectrum2_000889Spectrum3_000571
Show more names
EZ-Tamoxifene(E/Z)-Novaldex(E/Z)-MaMMatonTamoxifen (Mixture of Z and E Isomers)Tamoxifen Citrate Impurity 15 (E/Z)Tamoxifen2-(4-(1,2-Diphenylbut-1-en-1-yl)phenoxy)-N,N-dimethylethanamine1-[p-[2-(N,N-DiMethylaMino)ethoxy] phenyl]-1,2-diphenylbut-1-eneEthanamine, 2-[4-(1,2-diphenyl-1-buten-1-yl)phenoxy]-N,N-dimethyl-
Spectrum4_001145SCHEMBL4085[Z]-1-[p-Dimethylaminoethoxyphenyl]-1,2-diphenyl-1-buteneOprea1_111113KBioGR_000490KBioGR_001689KBioGR_002404KBioSS_000490
Database identifiers
- CAS
7728-73-6
Properties
Computed structural properties
- XLogP
- 7.1
- Topological polar surface area
- 12.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 8
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 463
Physicochemical properties
- Melting point
- 140 · 140-142 °C
- Boiling point
- 482.3 · 482.3±33.0 °C(Predicted)
- Density
- 1.042 · 1.042±0.06 g/cm3(Predicted)
- storage temp.
- -20 °C · Amber Vial, -20°C Freezer
- solubility
- Chloroform (Slightly), Methanol (Slightly)
- form
- Solid
- pka
- 8.66 · 8.66±0.28(Predicted)
- color
- White to Off-White
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Applications
UsesMixture of Tamoxifen and its (E)-isomer.
Suppliers14 total
广州隽沐生物科技股份有限公司020-36607679; 13502246435 · [email protected]
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]
凯试(上海)科技有限公司021-50135380 · [email protected]
湖北扬信医药科技有限公司15347293736 · [email protected]
深圳摩科生化科技有限公司18627923403 · [email protected]
BOC Sciences16314854226; +8616314854226 · [email protected]
深圳卓越生物医药科技有限公司26050679 18318671572 · [email protected]
sgtlifesciences pvt ltd+91-8790379245 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 13028896684 · [email protected]
湖北摩科化学有限公司18627753421; 18627756402 · [email protected]
TLC梯尔希（南京）药物研发有限公司18012923235 18012923235 · [email protected]
北京百灵威科技有限公司
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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