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Cas Database |
| Name |
2-(Dimethylamino)pyridine-5-boronic acid hydrate |
EINECS | N/A |
| CAS No. | 579525-46-5 | Density | 1.19g/cm3 |
| PSA | 65.82000 | LogP | -1.23690 |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C7H11BN2O2.H2O | Boiling Point | 352.3ºC at 760 mmHg |
| Molecular Weight | 165.988 | Flash Point | 166.8ºC |
| Transport Information | N/A | Appearance | N/A |
| Safety | Risk Codes | 22 | |
| Molecular Structure |
|
Hazard Symbols |
 Xi
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| Synonyms |
[2-(Dimethylamino)-pyridin-5-yl]boronic acid;[2-(N,N-Dimethylamino)pyridin-5-yl]boronicacid;Boronicacid, [6-(dimethylamino)-3-pyridinyl]- (9CI);[6-(Dimethylamino)pyridin-3-yl]boronic acid; |
Article Data | 6 |
2-(Dimethylamino)pyridine-5-boronic acid hydrate Specification
The 2-(Dimethylamino)pyridine-5-boronic acid hydrate, with the CAS registry number 579525-46-5, is also known as 2-(N,N-Dimethylamino)pyridine-5-boronic acid hydrate. It belongs to the product categories of Aminetertiary; Amino; Organoborons; Pyridine. This chemical's molecular formula is C7H11BN2O2.H2O and molecular weight is 184.00. Its IUPAC name is called [6-(dimethylamino)pyridin-3-yl]boronic acid hydrate. When you are using this chemical, please be cautious about it. This chemical may cause inflammation to the skin or other mucous membranes.
Physical properties of 2-(Dimethylamino)pyridine-5-boronic acid hydrate: (1)H-Bond Donor: 3; (2)H-Bond Acceptor: 5; (3)Rotatable Bond Count: 2; (4)Exact Mass: 184.101923; (5)MonoIsotopic Mass: 184.101923; (6)Topological Polar Surface Area: 57.6; (7)Heavy Atom Count: 13; (8)Formal Charge: 0; (9)Complexity: 143; (10)Covalently-Bonded Unit Count: 2.
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: B(C1=CN=C(C=C1)N(C)C)(O)O.O
(2)InChI: InChI=1S/C7H11BN2O2.H2O/c1-10(2)7-4-3-6(5-9-7)8(11)12;/h3-5,11-12H,1-2H3;1H2
(3)InChIKey: KIAVEKTZSDRSQT-UHFFFAOYSA-N
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