Basic Information | Post buying leads | Suppliers |
Name |
Hydroxylamine, O-(p-methoxybenzyl)-, hydrochloride |
EINECS | N/A |
CAS No. | 876-33-5 | Density | N/A |
PSA | 44.48000 | LogP | 2.58780 |
Solubility | N/A | Melting Point |
209-211°C |
Formula | C8H11NO2.ClH | Boiling Point | 286.5 °C at 760 mmHg |
Molecular Weight | 189.64 | Flash Point | 144.2 °C |
Transport Information | N/A | Appearance | N/A |
Safety | 26-36/37/39 | Risk Codes | 36/37/38 |
Molecular Structure | Hazard Symbols | Xn | |
Synonyms |
Benzyloxyamine,p-methoxy-, hydrochloride (7CI);Hydroxylamine, O-(p-methoxybenzyl)-, hydrochloride(8CI);Hydroxylamine, O-[(4-methoxyphenyl)methyl]-, hydrochloride (9CI);O-(4-Methoxybenzyl)hydroxylamine hydrochloride; |
This chemical is called Hydroxylamine, O-(p-methoxybenzyl)-, hydrochloride, and it can also be named as O-4-Methoxybenzylhydroxylamine hydrochloride. With the molecular formula of C8H11NO2.ClH, its molecular weight is 189.64. The CAS registry number of this chemical is 876-33-5.
Other characteristics of the Hydroxylamine, O-(p-methoxybenzyl)-, hydrochloride can be summarised as followings: (1)ACD/LogP: 1.46; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.44; (4)ACD/LogD (pH 7.4): 1.46; (5)ACD/BCF (pH 5.5): 7.22; (6)ACD/BCF (pH 7.4): 7.61; (7)ACD/KOC (pH 5.5): 141; (8)ACD/KOC (pH 7.4): 148.8; (9)#H bond acceptors: 3; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 21.7 Å2; (13)Flash Point: 144.2 °C; (14)Enthalpy of Vaporization: 52.56 kJ/mol; (15)Boiling Point: 286.5 °C at 760 mmHg; (16)Vapour Pressure: 0.00263 mmHg at 25°C.
When you are using this chemical, please be cautious about it as the following: This chemical is irritating to eyes, respiratory system and skin. You should wear suitable protective clothing when you use it. In case of contacting with eyes, rinse immediately with plenty of water and seek medical advice.
You can still convert the following datas into molecular structure:
1.SMILES: Cl.O(c1ccc(cc1)CON)C
2.InChI: InChI=1/C8H11NO2.ClH/c1-10-8-4-2-7(3-5-8)6-11-9;/h2-5H,6,9H2,1H3;1H
3.InChIKey: DHEZQYZJFCIQQA-UHFFFAOYAJ
The toxicity data is as follows:
Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
---|---|---|---|---|---|
mouse | LD50 | intraperitoneal | 650mg/kg (650mg/kg) | Journal of Medicinal Chemistry. Vol. 7, Pg. 329, 1964. |