| CAS Number | 1224449-13-1 |
| Catalog Number | AG009YG1(AGN-PC-0WCSJW) |
| Chemical Name | (4-(((1-(tert-butoxycarbonyl)piperidin-4-yl)oxy)methyl)phenyl)boronic acid |
| IUPAC Name | [4-[[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]oxymethyl]phenyl]boronic acid |
| InChI | InChI=1S/C17H26BNO5/c1-17(2,3)24-16(20)19-10-8-15(9-11-19)23-12-13-4-6-14(7-5-13)18(21)22/h4-7,15,21-22H,8-12H2,1-3H3 |
| InChI Key | QRAJJKKTWHWNET-UHFFFAOYSA-N |
| MDL Number | MFCD28400568 |
| Molecular Formula | C17H26BNO5 |
| Molecular Weight | 335.2030 |
| SMILES | C(C)(C)(C)OC(=O)N1CCC(CC1)OCC1=CC=C(C=C1)B(O)O |
| Synonyms | (4-(((1-(tert-butoxycarbonyl)piperidin-4-yl)oxy)methyl)phenyl)boronic acid,
1224449-13-1,
SCHEMBL3340942,
KS-00000SUY,
MFCD28400568,
ZINC203783480,
AM86411,
AK166728,
AS-49583,
(4-(((1-(t-Butoxycarbonyl)piperidin-4-yl)oxy)methyl)phenyl)boronic acid,
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| Complexity | 396 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 335.19g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 24 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 335.207g/mol |
| Monoisotopic Mass | 335.19g/mol |
| Rotatable Bond Count | 6 |
| Topological Polar Surface Area | 79.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
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Hazard Class
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Hazard statements
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H302
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Packing Group
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Precautionary statements
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P280-P305+P351+P338
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UN Code
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Certificate of Analysis
Lot Number