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| CAS No.: | 1919-91-1 |
|---|---|
| Name: | NAPHTHOL AS-BI PHOSPHATE |
| Molecular Structure: | |
|
|
|
| Formula: | C18H15BrNO6P |
| Molecular Weight: | 452.19 |
| Synonyms: | 2-Naphth-o-anisidide,7-bromo-3-hydroxy-, dihydrogen phosphate (7CI);2-Naphth-o-anisidide,7-bromo-3-hydroxy-, dihydrogen phosphate (ester) (8CI);2-Naphth-o-anisidide,7-bromo-3-hydroxy-, phosphate (6CI);Naphthol AS-BI phosphate; |
| EINECS: | 217-645-0 |
| Density: | 1.679 g/cm3 |
| Flash Point: | 37 °C |
| Appearance: | Light yellow crystalline powder |
| Hazard Symbols: |
 T, Xi, C, F
|
| Risk Codes: | 61-20/21-36/37/38-39/23/24/25-20/21/22-10-34-11 |
| Safety: | 7-16-36/37-45-36-26-36/37/39-23-53 |
| Transport Information: | UN 2265 3/PG 3 |
| PSA: | 114.90000 |
| LogP: | 4.40770 |
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Specification
The 2-Naphthalenecarboxamide,7-bromo-N-(2-methoxyphenyl)-3-(phosphonooxy)-, with the CAS registry number 1919-91-1, is also known as 6-Bromo-3-(o-hydroxyphenylaminocarbonyl)-2-naphthyl phosphate. It belongs to the product categories of Substrates; Cytochemistry Products; Hematology and Histology. Its EINECS registry number is 217-645-0. This chemical's molecular formula is C18H15BrNO6P and molecular weight is 452.192561. Its IUPAC name is called [6-bromo-3-[(2-methoxyphenyl)carbamoyl]naphthalen-2-yl] dihydrogen phosphate. This chemical is light yellow crystalline powder.
Physical properties of 2-Naphthalenecarboxamide,7-bromo-N-(2-methoxyphenyl)-3-(phosphonooxy)-: (1)XLogP3-AA: 3; (2)H-Bond Donor: 3; (3)H-Bond Acceptor: 6; (4)Rotatable Bond Count: 5; (5)Tautomer Count: 2; (6)Exact Mass: 450.982036; (7)MonoIsotopic Mass: 450.982036; (8)Topological Polar Surface Area: 105; (9)Heavy Atom Count: 27; (10)Formal Charge: 0; (11)Complexity: 572; (12)Covalently-Bonded Unit Count: 1.
When you are using this chemical, please be cautious about it as the following:
This chemical that at low levels can cause damage to health. It may catch fire in contact with air and only need brief contact with an ignition source which has a very low flash point or evolve highly flammable gases in contact with water. This chemical may cause inflammation to the skin or other mucous membranes. It is irritating to eyes, respiratory system and skin. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. Whenever you will contact it, please wear suitable protective clothing, gloves and eye/face protection.
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: COC1=CC=CC=C1NC(=O)C2=C(C=C3C=CC(=CC3=C2)Br)OP(=O)(O)O
(2)InChI: InChI=1S/C18H15BrNO6P/c1-25-16-5-3-2-4-15(16)20-18(21)14-9-12-8-13(19)7-6-11(12)10-17(14)26-27(22,23)24/h2-10H,1H3,(H,20,21)(H2,22,23,24)
(3)InChIKey: HUXIAXQSTATULQ-UHFFFAOYSA-N