- 5-Amino-2-(hydroxymethyl)benzeneboronic acid
- 5-Amino-2-(hydroxymethyl)benzeneboronic acid hydrochloride
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| Name |
5-Amino-2-(hydroxymethyl)benzeneboronic acid hydrochloride |
EINECS | N/A |
| CAS No. | 117098-93-8 | Density | N/A |
| PSA | 55.48000 | LogP | 0.86970 |
| Solubility | N/A | Melting Point |
300℃ |
| Formula | C7H8BNO2.HCl | Boiling Point | 353.7 °C at 760 mmHg |
| Molecular Weight | 221.45 | Flash Point | 167.7 °C |
| Transport Information | N/A | Appearance | N/A |
| Safety | Risk Codes |
 Xi:; |
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| Molecular Structure |
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Hazard Symbols |
 Xi
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| Synonyms |
2,1-Benzoxaborol-6-amine,1,3-dihydro-1-hydroxy-, hydrochloride (9CI);2,1-Benzoxaborole,6-amino-1,3-dihydro-1-hydroxy-, hydrochloride (6CI); |
5-Amino-2-(hydroxymethyl)benzeneboronic acid hydrochloride Specification
This chemical is called 5-Amino-2-(hydroxymethyl)benzeneboronic acid hydrochloride, and its systematic name is 1-hydroxy-3H-2,1-benzoxaborol-6-amine hydrochloride. With the molecular formula of C7H8BNO2.HCl, its molecular weight is 221.45. The CAS registry number of this chemical is 117098-93-8. In addition, its product categories are Blocks; BoronicAcids.
Other characteristics of the 5-Amino-2-(hydroxymethyl)benzeneboronic acid hydrochloride can be summarised as followings: (1)#H bond acceptors: 3; (2)#H bond donors: 3; (3)#Freely Rotating Bonds: 2; (4)Polar Surface Area: 55.48 Å2; (5)Flash Point: 167.7 °C; (6)Enthalpy of Vaporization: 63.18 kJ/mol; (7)Boiling Point: 353.7 °C at 760 mmHg; (8)Vapour Pressure: 1.3E-05 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: B1(c2cc(ccc2CO1)N)O.Cl
(2)InChI: InChI=1/C7H8BNO2.ClH/c9-6-2-1-5-4-11-8(10)7(5)3-6;/h1-3,10H,4,9H2;1H
(3)InChIKey: ZDCBDYGPSUVCOU-UHFFFAOYAR
(4)Std. InChI: InChI=1S/C7H8BNO2.ClH/c9-6-2-1-5-4-11-8(10)7(5)3-6;/h1-3,10H,4,9H2;1H
(5)Std. InChIKey: ZDCBDYGPSUVCOU-UHFFFAOYSA-N
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