| CAS Number | 1207443-48-8 |
| Catalog Number | AG008R3R(AGN-PC-0WAN65) |
| Chemical Name | 4-Ethoxy-2-methoxyphenylboronic acid |
| IUPAC Name | (4-ethoxy-2-methoxyphenyl)boronic acid |
| InChI | InChI=1S/C9H13BO4/c1-3-14-7-4-5-8(10(11)12)9(6-7)13-2/h4-6,11-12H,3H2,1-2H3 |
| InChI Key | WMVVZNXFUFZMPF-UHFFFAOYSA-N |
| MDL Number | MFCD04037217 |
| Molecular Formula | C9H13BO4 |
| Molecular Weight | 196.0081 |
| SMILES | COC1=CC(OCC)=CC=C1B(O)O |
| Synonyms | (4-Ethoxy-2-methoxyphenyl)boronic acid,
1207443-48-8,
4-ETHOXY-2-METHOXYPHENYLBORONIC ACID,
AK141210,
SCHEMBL3241115,
CTK6G1508,
DTXSID60669990,
KS-00000RU2,
MFCD04037217,
AKOS006276743,
ZINC169894043,
AB17001,
DS-7235,
AX8281403,
ACN-046560,
(4-ETHOXY-2-METHOXYPHENYL)BORONIC ACID PINACOL ESTER,
|
| Complexity | 165 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 196.091g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 196.009g/mol |
| Monoisotopic Mass | 196.091g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 58.9A^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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H315-H319-H335
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Packing Group
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Precautionary statements
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P261-P305+P351+P338
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UN Code
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Certificate of Analysis
Lot Number