Lot numbers can be found on the outside label of a product:
6-Bromovanillin
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CAS No. 60632-40-8
- Cat. No. CS-W005482
- Purity≥98%
- MDL No.MFCD01119128
*For research and further manufacturing use only, not for direct human use.
Structure of 60632-40-8
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General Information
- CAS No. 60632-40-8
- Cat. No. CS-W005482
- Purity ≥98%
- MDL No. MFCD01119128
- Storage 4°C, stored under nitrogen
- Shipping Room temperature in continental US; may vary elsewhere.
- Molecular Formula C₈H₇BrO₃
- Molecular Weight 231.04
- Synonym(s) None
- SMILES O=CC1=CC(OC)=C(O)C=C1Br
Description
6-Bromovanillin features a bromine substituent at the para position relative to the aldehyde group, enhancing electronic modulation and reactivity in cross-coupling processes. This bench-stable compound integrates readily into synthetic sequences requiring halogenated aromatic aldehydes, offering improved functional group tolerance and streamlined handling under standard conditions.
Application
6-Bromovanillin serves as a versatile building block in medicinal chemistry and materials science, enabling direct functionalization via palladium-catalyzed cross-coupling reactions. Its brominated aromatic ring and aldehyde functionality provide orthogonal reactivity for late-stage diversification, while the phenolic hydroxyl group offers opportunities for derivatization or protection. Bench-stable and readily purified by recrystallization, it functions efficiently in standard synthetic workflows requiring halogenated vanillin analogs.
Synthesis
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Route1
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In-stock
881-68-5 - ~91%
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In-stock
60632-40-8
References
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Lai, Chien-Hsun; Shen, Yi-Ling; Wang, Min-Nen; Rao, N. S. Kameswara; Liao, Chun-Chen Journal of Organic Chemistry, 2002 , vol. 67, # 18 p. 6493 - 6502
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Route2
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52783-83-2 - ~95%
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In-stock
60632-40-8
References
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Takaya, Daisuke; Yamashita, Atsuya; Kamijo, Kazue; Gomi, Junko; Ito, Masahiko; Maekawa, Shinya; Enomoto, Nobuyuki; Sakamoto, Naoya; Watanabe, Yoshiaki; Arai, Ryoichi; Umeyama, Hideaki; Honma, Teruki; Matsumoto, Takehisa; Yokoyama, Shigeyuki Bioorganic and Medicinal Chemistry, 2011 , vol. 19, # 22 p. 6892 - 6905
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Route3
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52783-67-2 - ~74%
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In-stock
60632-40-8
References
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Wunsch; Nerdinger Archiv der Pharmazie, 1995 , vol. 328, # 4 p. 301 - 305
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Safety Information
Download SDS|
GHS Pictogram :
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GHS No : GHS07,GHS08
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Signal Word : Danger
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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-H334
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Precautionary Statements : P261-P264-P270-P285-P330-P501
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Quality Control
Computational Chemistry Data
- TPSA 46.53
- LogP 1.9758
- H_Acceptors 3
- H_Donors 1
- Rotatable_Bonds 2
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Key Words
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