Lot numbers can be found on the outside label of a product:
5-Bromo-2-anisaldehyde
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CAS No. 25016-01-7
- Cat. No. CS-M0570
- Purity≥98%
- MDL No.MFCD00003347
*For research and further manufacturing use only, not for direct human use.
Structure of 25016-01-7
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General Information
- CAS No. 25016-01-7
- Cat. No. CS-M0570
- Purity ≥98%
- MDL No. MFCD00003347
- Storage 4°C, stored under nitrogen
- Shipping Room temperature in continental US; may vary elsewhere.
- Molecular Formula C₈H₇BrO₂
- Molecular Weight 215.04
- Synonym(s) 5-bromo-ortho-anisaldehyde
- SMILES O=CC1=C(OC)C=CC(Br)=C1
Description
(R)-1-[alpha-(4-Chlorophenyl)benzyl]piperazine intermediate in the production of (R)-Cetirizine.
Application
5-Bromo-2-anisaldehyde serves as a versatile building block in synthetic organic chemistry, enabling efficient access to substituted heterocycles and biologically relevant scaffolds. Its compatibility with Suzuki-Miyaura and Negishi coupling reactions facilitates C–C bond formation under mild conditions. The aldehyde functionality allows for facile derivatization via reductive amination or Wittig-type transformations, while the bromo and methoxy groups provide orthogonal handles for further functionalization. Bench-stable and readily purified by column chromatography, it functions effectively in both medicinal chemistry and materials synthesis workflows.
Synthesis
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Route1
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135-02-4 - ~95%
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In-stock
25016-01-7
References
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Pingali, Subramanya R.K.; Madhav, Monika; Jursic, Branko S. Tetrahedron Letters, 2010 , vol. 51, # 10 p. 1383 - 1385
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Route2
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77-78-1 -
In-stock
1761-61-1 - ~92%
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In-stock
25016-01-7
References
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Silva, Ana L.; Quiroz, Beatriz; Maldonado, Luis A. Tetrahedron Letters, 1998 , vol. 39, # 15 p. 2055 - 2058
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Route3
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In-stock
1761-61-1
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74-88-4
- ~95%
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In-stock
25016-01-7
References
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Teichert, Johannes F.; Feringa, Ben L. Chemical Communications, 2011 , vol. 47, # 9 p. 2679 - 2681
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Safety Information
Download SDS|
GHS Pictogram :
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GHS No : GHS07
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Signal Word : Warning
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UN#: N/A
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Class : N/A
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Packing Group : N/A
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Hazard Statements : H302-H411
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Precautionary Statements : P264-P270-P273-P330-P391-P501
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Quality Control
Computational Chemistry Data
- TPSA 26.3
- LogP 2.2702
- H_Acceptors 2
- H_Donors 0
- Rotatable_Bonds 2
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Key Words
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