Cas no 887831-90-5 (3-(N-BOC-N-methylamino)phenylboronic acid)
3-(N-BOC-N-methylamino)phenylboronic acid Chemical and Physical Properties
Names and Identifiers
-
- (3-((tert-Butoxycarbonyl)(methyl)amino)phenyl)boronic acid
- [3-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]phenyl]boronic acid
- 3-(N-BOC-N-methylamino)phenylboronic acid
- MFCD03095104
- CS-0174258
- 3-(N-BOC-N-methylamino)phenylboronicacid
- DTXSID70716580
- BS-24005
- 887831-90-5
- AKOS015893119
- A861456
- (3-{[(tert-butoxy)carbonyl](methyl)amino}phenyl)boronic acid
- {3-[(tert-Butoxycarbonyl)(methyl)amino]phenyl}boronic acid
- 3-[(TERT-BUTOXYCARBONYL)(METHYL)AMINO]PHENYLBORONIC ACID
- 3-{[(tert-Butoxy)carbonyl](ethyl)amino}phenylboronic acid
-
- MDL: MFCD03095104
- Inchi: 1S/C12H18BNO4/c1-12(2,3)18-11(15)14(4)10-7-5-6-9(8-10)13(16)17/h5-8,16-17H,1-4H3
- InChI Key: QFRSVPDEEDBLOS-UHFFFAOYSA-N
- SMILES: O(C(N(C)C1C=CC=C(B(O)O)C=1)=O)C(C)(C)C
Computed Properties
- Exact Mass: 251.13300
- Monoisotopic Mass: 251.1328882g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 18
- Rotatable Bond Count: 5
- Complexity: 290
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 70?2
Experimental Properties
- PSA: 70.00000
- LogP: 0.73770
3-(N-BOC-N-methylamino)phenylboronic acid Customs Data
- HS CODE:2931900090
- Customs Data:
China Customs Code:
2931900090Overview:
2931900090. Other organic-Inorganic compound. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:AB(Customs clearance form for Inbound Goods,Customs clearance form for outbound goods). MFN tariff:6.5%. general tariff:30.0%
Summary:
2931900090. other organo-inorganic compounds. VAT:17.0%. Tax rebate rate:13.0%. Supervision conditions:AB(certificate of inspection for goods inward,certificate of inspection for goods outward). MFN tariff:6.5%. General tariff:30.0%
3-(N-BOC-N-methylamino)phenylboronic acid Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| Alichem | A019113201-5g |
(3-((tert-Butoxycarbonyl)(methyl)amino)phenyl)boronic acid |
887831-90-5 | 95% | 5g |
$712.80 | 2023-08-31 | |
| Chemenu | CM124366-1g |
(3-((tert-Butoxycarbonyl)(methyl)amino)phenyl)boronic acid |
887831-90-5 | 95+% | 1g |
$269 | 2021-08-05 | |
| Chemenu | CM124366-1g |
(3-((tert-Butoxycarbonyl)(methyl)amino)phenyl)boronic acid |
887831-90-5 | 95%+ | 1g |
$*** | 2023-05-29 | |
| abcr | AB309589-1 g |
3-(N-BOC-N-methylamino)phenylboronic acid, 97%; . |
887831-90-5 | 97% | 1g |
€314.00 | 2023-04-26 | |
| abcr | AB309589-5 g |
3-(N-BOC-N-methylamino)phenylboronic acid, 97%; . |
887831-90-5 | 97% | 5g |
€858.00 | 2023-04-26 | |
| TRC | B601115-100mg |
3-(N-BOC-N-methylamino)phenylboronic acid |
887831-90-5 | 100mg |
$ 81.00 | 2023-04-18 | ||
| TRC | B601115-250mg |
3-(N-BOC-N-methylamino)phenylboronic acid |
887831-90-5 | 250mg |
$ 155.00 | 2023-04-18 | ||
| TRC | B601115-500mg |
3-(N-BOC-N-methylamino)phenylboronic acid |
887831-90-5 | 500mg |
$ 236.00 | 2023-04-18 | ||
| TRC | B601115-1g |
3-(N-BOC-N-methylamino)phenylboronic acid |
887831-90-5 | 1g |
$ 333.00 | 2023-04-18 | ||
| 1PlusChem | 1P004DFM-5g |
3-(N-BOC-N-methylamino)phenylboronic acid |
887831-90-5 | 97% | 5g |
$566.00 | 2025-02-21 |
3-(N-BOC-N-methylamino)phenylboronic acid Related Literature
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Eléonore Resongles,Corinne Casiot,Fran?oise Elbaz-Poulichet,Rémi Freydier,Odile Bruneel,Christine Piot,Sophie Delpoux,Aurélie Volant,Angélique Desoeuvre Environ. Sci.: Processes Impacts, 2013,15, 1536-1544
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Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
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Nan Fu,Naphaporn Chiewchan,Xiao Dong Chen Food Funct., 2020,11, 211-220
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Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
Additional information on 3-(N-BOC-N-methylamino)phenylboronic acid
Comprehensive Guide to 3-(N-BOC-N-methylamino)phenylboronic acid (CAS 887831-90-5): Properties, Applications, and Industry Insights
3-(N-BOC-N-methylamino)phenylboronic acid (CAS 887831-90-5) is a specialized boronic acid derivative widely recognized for its role in organic synthesis, particularly in Suzuki-Miyaura cross-coupling reactions. This compound features a BOC-protected methylamino group and a phenylboronic acid moiety, making it a versatile building block for pharmaceuticals, agrochemicals, and advanced materials. Its molecular formula, C12H18BNO4, and precise structure ensure high reactivity in controlled environments.
In recent years, the demand for boronic acid-based reagents has surged due to their applications in drug discovery and bioconjugation. Researchers frequently search for "BOC-protected boronic acids" or "CAS 887831-90-5 suppliers," reflecting its industrial relevance. The compound’s stability under N-BOC protection allows for selective deprotection, enabling complex molecular architectures—a key focus in medicinal chemistry and peptide synthesis.
The synthesis of 3-(N-BOC-N-methylamino)phenylboronic acid involves multi-step organic reactions, often starting from 3-aminophenylboronic acid. Its N-methylation and subsequent BOC protection yield a stable intermediate compatible with palladium-catalyzed couplings. This process aligns with green chemistry trends, as users increasingly seek "sustainable boronic acid derivatives" or "eco-friendly coupling reagents."
Applications of this compound extend to proteomics research and biomarker development, where its boronate ester formation with diols is exploited for sensing. The rise of "AI-driven compound optimization" has further spotlighted CAS 887831-90-5, as machine learning models predict its reactivity in novel catalytic systems. Its compatibility with high-throughput screening also makes it valuable for pharmaceutical libraries.
Storage and handling of 3-(N-BOC-N-methylamino)phenylboronic acid require anhydrous conditions to prevent hydrolysis. Suppliers often highlight its purity (>95%) and HPLC validation data, addressing user queries like "how to store boronic acids" or "BOC stability under acidic conditions." These details are critical for GMP-compliant manufacturing.
In summary, 3-(N-BOC-N-methylamino)phenylboronic acid (CAS 887831-90-5) bridges academic research and industrial applications, driven by its structural uniqueness and reaction versatility. As the scientific community explores "next-generation boronic acid catalysts," this compound remains at the forefront of innovation.
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