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| CAS No.: | 15231-91-1 |
|---|---|
| Name: | 6-Bromo-2-naphthol |
| Article Data: | 48 |
| Molecular Structure: | |
|
|
|
| Formula: | C10H7BrO |
| Molecular Weight: | 223.069 |
| Synonyms: | 2-Naphthol,6-bromo- (7CI,8CI);2-Bromo-6-hydroxynaphthalene;2-Hydroxy-6-bromonaphthalene;6-Bromo-2-hydroxynaphthalene;6-Bromo-2-naphthalinol;6-Bromo-b-naphthol;6-Hydroxy-2-bromonaphthalene;NSC 17563;6-Bromo-2-naphthol; |
| EINECS: | 239-279-0 |
| Density: | 1.614 g/cm3 |
| Melting Point: | 122-124 °C(lit.) |
| Boiling Point: | 353.8 °C at 760 mmHg |
| Flash Point: | 167.8 °C |
| Solubility: | 不溶于水，溶于醇。 |
| Appearance: | off-white to beige powder |
| Hazard Symbols: |
 Xi
|
| Risk Codes: | 36/37/38 |
| Safety: | 26-36-37/39 |
| PSA: | 20.23000 |
| LogP: | 3.30790 |
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Specification
1.Introduction of 6-Bromo-2-naphthol
The 6-Bromo-2-naphthol, with its CAS NO 15231-91-1, is a kind of Off gray crystal powder.It has the synonyms of AI3-18464 ; Bromo-6 naphtol-2 ; NSC 17563 ; 6-bromo-2-Naphthalenol and 2-Naphthol, 6-bromo-. 6-Bromo-2-naphthol should be stored in shady and cool warehouse and mainly used as pharmaceutical Intermediates.
2.Properties of 6-Bromo-2-naphthol
(1) Flash Point: 167.8 °C (2) Density: 1.614 g/cm3 (3) Surface Tension: 55.2 dyne/cm
(4) Enthalpy of Vaporization: 62.24 kJ/mol (5) Vapour Pressure: 1.71E-05 mmHg at 25°C (6) XLogP3-AA: 3.4
(7) H-Bond Donor: 1 (8) H-Bond Acceptor: 1
3.Structure descriptors of 6-Bromo-2-naphthol
IUPAC Name: 6-bromonaphthalen-2-ol
InChI: InChI=1S/C10H7BrO/c11-9-3-1-8-6-10(12)4-2-7(8)5-9/h1-6,12H
InChIKey: YLDFTMJPQJXGSS-UHFFFAOYSA-N
Canonical SMILES : C1=CC2=C(C=CC(=C2)Br)C=C1O
4.Safety information of 6-Bromo-2-naphthol
Hazard Codes: 
Xi
Risk Statements: 36/37/38
36: Irritating to the eyes
37: Irritating to the respiratory system
38: Irritating to the skin
Safety Statements: 26-36-37/39
26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice
36: Wear suitable protective clothing
37: Wear suitable gloves
39: Wear eye/face protection
WGK Germany: 3
RTECS: QL3365000
Hazard Note: Irritant
5.Toxity data of 6-Bromo-2-naphthol
| Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
|---|---|---|---|---|---|
| mouse | LD50 | intraperitoneal | 325mg/kg (325mg/kg) | European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 13, Pg. 381, 1978. |