6-ベンゾイル-2-ナフトール

6-Benzoyl-2-naphthol

HCID 93271
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基本情報

CAS
52222-87-4
標準SMILES
O=C(c1ccccc1)c1ccc2cc(O)ccc2c1
InChIKey
MJKZGSBXCWNUHV-UHFFFAOYSA-N
分子式
C17H12O2
平均分子量
248.27 g/mol
単同位体質量
248.08372962

名称と識別子

優先名称
6-Benzoyl-2-naphthol
IUPAC
(6-hydroxynaphthalen-2-yl)-phenylmethanone
現地名
6-ベンゾイル-2-ナフトール
英語名
6-BENZOYL-2-NAPHTHOL
分子式
C17H12O2
分子量
248.28

名称と別名

6-Benzoyl-2-naphthol52222-87-4Ketone, 6-hydroxy-2-naphthyl phenylUVY9GCI1OVMethanone, (6-hydroxy-2-naphthalenyl)phenyl-EINECS 257-755-6NSC 157897UNII-UVY9GCI1OVBRN 3294044(6-HYDROXY-2-NAPHTHALENYL)PHENYLMETHANONENaphthalene, 2-hydroxy-6-benzoyl-NSC-157897
名称をさらに表示
6-ベンゾイル-2-ナフトール(6-ヒドロキシナフタレン-2-イル)フェニルケトン6-ベンゾイルナフタレン-2-オールフェニル(6-ヒドロキシ-2-ナフチル)ケトン6-BENZOYL-2-NAPHTHOL 98%6-Benzoylnaphthalene-2-ol6-BENZOYL-2-NAPHTHOL, 98+%ketone,6-hydroxy-2-naphthylphenylPhenyl(6-hydroxy-2-naphtyl) ketone6-HYDROXY-2-NAPHTHYL PHENYL KETONE(6-Hydroxy-2-naphthyl)(phenyl)methanone
3-08-00-01613 (Beilstein Handbook Reference)DTXSID30200273Methanone, (6-hydroxy-2-naphthalenyl) phenyl(6-HYDROXYNAPHTHALEN-2-YL)PHENYLMETHANONERefChem:104250DTXCID30122764Methanone, (6-hydroxy-2-naphthalenyl)phenyl-(9CI)257-755-6

データベース識別子

CAS
52222-87-4
PubChem CID
93271
DTXSID
DTXSID30200273
ChEMBL
CHEMBL1496592
UNII
UVY9GCI1OV
EC Number
257-755-6
Nikkaji
J71.226D

物性

構造計算による物性

XLogP
4.2
極性表面積
37.3 Ų
水素結合供与体数
1
水素結合受容体数
2
回転可能結合数
2
重原子数
19

物理化学的性質

融点
161 · 161-162 °C (lit.)
沸点
351.35 °C · 351.35°C (rough estimate)
比重(密度)
1.129 · 1.1290 (rough estimate)
屈折率
1.6 · 1.6000 (estimate)
溶解性
50 mg/mL · エタノール：可溶50mg/mL
酸解離定数(Pka)
8.77 · 8.77±0.40(Predicted)

安全と法規制

GHS分類

GHS Classification · 5 件

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 39 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

危険有害性情報

Hazard Classes and CategoriesSkin Irrit. 2 (100%)；Eye Irrit. 2 (100%)；STOT SE 3 (100%)

安全データ

wgk
3
rtecs
OB4360000
毒性
otr-ham:kdy 80 mg/L BJCAAI 37,873,78
risk_code
36/37/38
hazard_code
Xi
safety_code
26-36

化学と産業

応用分野 · 1 件

使用6-Benzoyl-2-naphthol was used in the synthesis of potassium 6-benzoyl-2-naphthyl sulfate, substrate for histochemical investigation of aryl sulfatase activity. It was also used in preparation of substrate for histochemical demonstration of acid phosphatase in the organs of albino rat.

サプライヤー15 社

郑州汇聚化工有限公司0371-53399770 18037166334 · [email protected]
Aladdin Scientific[email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
上海耐士化工科技有限公司400-188-0725 +86 21 34310725 13611771617
Sigma-Aldrich西格玛奥德里奇(上海)贸易有限公司021-61415566 800-8193336 · [email protected]

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