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CAS No.: | 51761-16-1 |
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Name: | 7-amino-2-naphthol hydrochloride |
Molecular Structure: | |
Formula: | C10H10ClNO |
Molecular Weight: | 195.6455 |
Synonyms: | 7-Amino-2-naphthol hydrochloride (1:1); |
EINECS: | 257-388-1 |
Boiling Point: | 405.3 °C at 760 mmHg |
Flash Point: | 198.9 °C |
PSA: | 46.25000 |
LogP: | 3.51080 |
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The 2-Naphthalenol,7-amino-, hydrochloride (1:1), with the CAS registry number of 51761-16-1, is also known as 7-Amino-2-naphthol hydrochloride (1:1). Its EINECS registry number is 257-388-1. Its molecular formula is C10H10ClNO and molecular weight is 195.6455. What's more, its IUPAC name is (8-Hydroxynaphthalen-2-yl)azanium chloride.
Physical properties about the 2-Naphthalenol,7-amino-, hydrochloride (1:1) are: (1)ACD/LogP: 1.43; (2)# of Rule of 5 Violations: 0 ; (3)#H bond acceptors: 2; (4)#H bond donors: 3; (5)#Freely Rotating Bonds: 2; (6)Polar Surface Area: 46.25 Å2; (7)Flash Point: 198.9 °C; (8)Enthalpy of Vaporization: 68.25 kJ/mol; (9)Boiling Point: 405.3 °C at 760 mmHg; (10)Vapour Pressure: 3.77E-07 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: Cl.Nc1cc2cc(O)ccc2cc1
(2) InChI: InChI=1/C10H9NO.ClH/c11-9-3-1-7-2-4-10(12)6-8(7)5-9;/h1-6,12H,11H2;1H
(3) InChIKey: VDFLTUHMDULKQC-UHFFFAOYAD
The toxicity data is as follows:
Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
---|---|---|---|---|---|
mouse | LD50 | intravenous | 180mg/kg (180mg/kg) | U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#04023, |