3-Chloro-6-hydroxy-2,4-dimethylbenzaldehyde

HCID 3335082

ノート反応

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基本情報

CAS: 81322-67-0
標準SMILES: Cc1cc(O)c(C=O)c(C)c1Cl
InChIKey: NXNLQPJNVDGFOE-UHFFFAOYSA-N
分子式: C9H9ClO2
平均分子量: 184.62 g/mol
単同位体質量: 184.02910721

名称と識別子

優先名称: 3-Chloro-6-hydroxy-2,4-dimethylbenzaldehyde
IUPAC: 3-chloro-6-hydroxy-2,4-dimethylbenzaldehyde
英語名: 5-Chloro-2-hydroxy-4-methyl-benzaldehyde
分子式: C9H9ClO2
分子量: 184.62

名称と別名

3-chloro-6-hydroxy-2,4-dimethylbenzaldehyde81322-67-03-chloro-2,4-dimethyl-6-hydroxybenzaldehydeDTXSID00391566RefChem:500290DTXCID50342427617-217-73-Chloro-6-hydroxy-2,4-dimethyl-benzaldehyde3,5-dimethyl-4-chloro-2-formylphenolMFCD00732125SCHEMBL2923107NXNLQPJNVDGFOE-UHFFFAOYSA-N

名称をさらに表示

AKOS BB-6947AKOS BB-69332-(Naphthalen-1-yl)acetamide5-Chloro-2-hydroxy-4-methyl-benzaldehyde3-Chloro-2,4-dimethyl-6-hydroxybenzaldehyde98%Benzaldehyde, 3-chloro-6-hydroxy-2,4-diMethyl-3-Chloro-2,4-dimethyl-6-hydroxybenzaldehyde 98%

SBB0647095-chloro-4,6-dimethyl-salicylaldehydeAKOS000103410PS-8513SB85424BP-10500DB-046197CS-0172049

データベース識別子

CAS: 81322-67-0
PubChem CID: 3335082
DTXSID: DTXSID00391566
EC Number: 617-217-7

物性

構造計算による物性

XLogP: 2.9
極性表面積: 37.3 Å²
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: 1
重原子数: 12
形式電荷: 0
複雑度: 172

物理化学的性質

融点: 89 · 89-90 °C
沸点: 272.5 · 272.5±35.0 °C(Predicted)
比重(密度): 1.281 · 1.281±0.06 g/cm3(Predicted)
貯蔵温度: 2 · 2-8°C
酸解離定数(Pka): 7.97 · 7.97±0.28(Predicted)
CAS データベース: 81322 · 81322-67-0(CAS DataBase Reference)

安全と法規制

GHS分類

GHS Classification · 4 件

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/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)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

危険有害性情報

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

安全データ

hs_code: 2913000090
risk_code: 36
hazard_code: Xi
hazard_note: Irritant
safety_code: 26

化学と産業

サプライヤー18 社

Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]

杭州品高化工有限公司0571-87658025 · [email protected]

上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]

Hangzhou Sage Chemical Co., Ltd.+86057186818502 13588463833 · [email protected]

陕西麟邦实业有限公司17709134430 · [email protected]

化合物ノート

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