基本情報
- CAS
607-30-7- 標準SMILES
ONc1cccc2ccccc12- InChIKey
CWFINLADSFPMHF-UHFFFAOYSA-N- 分子式
- C10H9NO
- 平均分子量
- 159.18 g/mol
- 単同位体質量
- 159.06841391
概要
N-hydroxynaphthalen-1-amine is a N-substituted amine. It is functionally related to a 1-naphthylamine.
名称と識別子
- 優先名称
- N-hydroxy-1-naphthalenamine
- IUPAC
- N-naphthalen-1-ylhydroxylamine
- 現地名
- N-ヒドロキシ-1-ナフタレンアミン
- 英語名
- N-hydroxy-1-naphthylamine
- 分子式
- C10H9NO
- 分子量
- 159.18
名称と別名
1-NAPHTHYLHYDROXYLAMINEN-Hydroxy-1-naphthylamineN-Hydroxy-1-naphthalenamine1-Hydroxyaminonaphthalenealpha-Naphthylhydroxylamine607-30-7N-1-NaphthylhydroxylamineHydroxylamine, N-1-naphthyl-1-Naphthalenamine, N-hydroxy-5O045G232PDTXSID40209510RefChem:76546
名称をさらに表示
N-(1-ナフチル)ヒドロキシルアミンN-ヒドロキシ-1-ナフタレンアミンN-(ナフタレン-1-イル)ヒドロキシルアミンN-(1-Naphtyl)hydroxylamine(Z)-naphthalen-1(8aH)-one oxiMe
DTXCID90132001N-Hydroxy-1-aminonaphthaleneN-(naphthalen-1-yl)hydroxylamineN-naphthalen-1-ylhydroxylamineN-hydroxynaphthalen-1-amineCCRIS 1175HSDB 2142BRN 2638939
データベース識別子
- CAS
607-30-7- PubChem CID
- 11828
- DTXSID
DTXSID40209510- ChEMBL
CHEMBL261899- ChEBI
CHEBI:34871- UNII
- 5O045G232P
- Nikkaji
- J2.985H
物性
構造計算による物性
- XLogP
- 2.4
- 極性表面積
- 32.3 Ų
- 水素結合供与体数
- 2
- 水素結合受容体数
- 2
- 回転可能結合数
- 1
- 重原子数
- 12
- 形式電荷
- 0
- 複雑度
- 149
実験および物理化学的性質
Chemical ClassesNitrogen Compounds -> Naphthylamines
物理化学的性質
- 融点
- 79 °C · 79°C
- 沸点
- 284.68 °C · 284.68°C (rough estimate)
- 比重(密度)
- 1.1202 · 1.1202 (rough estimate)
- 屈折率
- 1.546 · 1.5460 (estimate)
- 酸解離定数(Pka)
- 9 · 9.00±0.30(Predicted)
安全と法規制
安全情報は参考情報です。供給元の安全データシート（SDS）、適用法令、専門家による評価に代わるものではありません。
危険有害性情報
Hazards SummaryA strong eye and mucous membrane irritant; A corrosive substance that may cause damage to skin; [HSDB] Tumorigenic; [RTECS] See beta-Naphthylamine and alpha-Naphthylamine.
毒性情報
Adverse EffectsDermatotoxin - Skin burns.
Human Toxicity Excerpts
...CORROSIVE TO SKIN & HIGHLY IRRITANT TO EYES & MUCOUS MEMBRANES. REPEATED EXPOSURE MAY ENHANCE ALLERGIC REACTION PARTICULARLY OF BACK OF HANDS & FOREARMS FROM 1-2 WK TO 2-5 YR AFTER COMMENCEMENT OF EXPOSURE & CASES OF ECZEMA...FOLLOWING PROLONGED CONTACT. ... NO CASES OF SYSTEMIC POISONING...IN WORKERS. /HYDROXYLAMINE/
/HYDROXYLAMINE IS/ ABOUT EQUIPOTENT TO NITRITE AS METHEMOGLOBIN FORMER, BUT IT HAS GREATER TENDENCY TO PRODUCE SULFHEMOGLOBIN, HEINZ BODIES & OTHER IRREVERSIBLE RED CELL DAMAGE. /PRC: N-1-NAPHTHYLHYDROXYLAMINE IS NOT EXPECTED TO CAUSE EXTENSIVE METHEMOGLOBIN WHEN COMPARED TO HYDROXYLAMINE./ ... SYSTEMIC POISONING CHARACTERIZED BY CYANOSIS, CONVULSIONS & COMA. /HYDROXYLAMINE/
Non-Human Toxicity Excerpts
/HIGH CONCN/ IN ANIMALS...CAUSES CONVULSIONS FOLLOWED BY PARALYSIS & DEATH FROM CESSATION OF BREATHING... CHRONIC ABSORPTION OF MODERATE DOSES (1 MG/KG) MAY LEAD TO SLIGHT ANEMIA. /HYDROXYLAMINE/
...INHIBITOR OF CATALASE &...WHEN ADMIN PARENTERALLY, 40 MG CAUSING CONVULSIONS, NYSTAGMUS & DEATH IN RABBIT. LOCAL APPLICATION OF 10% SOLN...TO RABBIT EYES...CAUSED MODERATE INFLAMMATION OF CONJUNCTIVA. /HYDROXYLAMINE/
HYDROXYLAMINE ELEVATES BRAIN GABA /GAMMA-AMINOBUTYRIC ACID/ LEVELS IN RATS. /HYDROXYLAMINE/
CHEMICAL SYNTHESIS OF 1-NAPHTHYLHYDROXYLAMINE SHOWED THAT THIS COMP IS TUMORIGENIC IN /RATS/ & MORE POTENT THAN 2-NAPHTHYLHYDROXYLAMINE. NEITHER COMPD INDUCES BLADDER TUMORS IN /RATS/ BUT BOTH CAUSE LIVER TUMORS.
For more Non-Human Toxicity Excerpts (Complete) data for 1-NAPHTHYLHYDROXYLAMINE (6 total), please visit the HSDB record page.
安全データ
化学と産業
薬理情報
Mechanism of ActionTHE CARCINOGEN N-HYDROXY-1-NAPHTHYLAMINE REACTED WITH NUCLEIC ACID & PROTEIN UNDER SLIGHTLY ACIDIC CONDITIONS (PH5) TO FORM COVALENTLY BONDED DERIV WITH 3 TO 20 NAPHTHYL RESIDUES/1000 MONOMER UNITS.
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