1,3-Dimethoxybenzene (HCID 178757762)

概要

1,3-Dimethoxybenzene is a member of methoxybenzenes.

名称と識別子

優先名称: 1,3-Dimethoxybenzene
IUPAC: 1,3-dimethoxybenzene
現地名: 1,3-ジメトキシベンゼン-2,4,5,6-D4
英語名: 1,3-DIMETHOXYBENZEN-2,4,5,6-D4
分子式: C8H10O2
分子量: 138.17

名称と別名

1,3-Dimethoxybenzene151-10-0Resorcinol dimethyl etherBenzene, 1,3-dimethoxy-M-DIMETHOXYBENZENE3-MethoxyanisoleBenzene, m-dimethoxy-Dimethyl resorcinolDimethylether resorcinoluFEMA No. 2385DTXSID20470602694Z07HQY

名称をさらに表示

1,3-ジメトキシベンゼン-2,4,5,6-D41,3‐ジメトキシベンゼン‐2,4,5,6‐D41,3-DiMethoxybenzene-d41,3-DIMETHOXYBENZEN-2,4,5,6-D41,3-DIMETHOXYBENZENE-2,4,5,6-D4

meta-dimethoxybenzeneNSC-8699DTXCID0027060RefChem:72695205-783-4DimethylresorcinolMethoxyanisole, m-m-Methoxyanisole

データベース識別子

CAS: 362049-44-3
ChEMBL: CHEMBL2252486
ChEBI: CHEBI:89853
UNII: 2694Z07HQY
EC Number: 205-783-4
Nikkaji: J5.861K

物性

構造計算による物性

XLogP: 2.2
極性表面積: 18.5 Å²
水素結合供与体数: 0
水素結合受容体数: 2
回転可能結合数: 2
重原子数: 10
形式電荷: 0
複雑度: 83.3

実験および物理化学的性質

Chemical ClassesOther Classes -> Ethers, Other

SpringerMaterials Properties13C nuclear magnetic resonance spectrum

FragrancesFragrance Ingredient (m-Dimethoxybenzene) -> IFRA transparency List

LogP · 2 件

2.21

Food AdditivesFLAVORING AGENT OR ADJUVANT -> FDA Substance added to food

Density · 2 件

1.053-1.057

1.0521 @25 °C

安全と法規制

GHS分類

GHS Classification · 6 件

This chemical does not meet GHS hazard criteria for 97.5% (268 of 275) of all reports.

Not Classified

Aggregated GHS information provided per 275 reports by companies from 4 notifications to the ECHA C&L Inventory.

Warning

H227: Combustible liquid [Warning Flammable liquids]

P210, P280, P370+P378, P403, and P501 (click each P-code to see the statement)

危険有害性情報

Regulatory Information · 4 件

Chemical: Benzene, 1,3-dimethoxy-

Commission Regulation (EC) No 1565/2000 (Repealed by Com. Implementing Reg. (EU) No 872/2012)

Status: Active Update: 27-11-2019 https://echa.europa.eu/registration-dossier/-/registered-dossier/19544

Benzene, 1,3-dimethoxy-: Does not have an individual approval but may be used under an appropriate group standard

Hazards Summary · 1 件

Causes somnolence, tremor, and ataxia in intraperitoneal lethal-dose studies of mice (LD50 = 900 mg/kg); [RTECS] Safe when used as a flavoring agent in food; [JECFA] A mild skin and eye irritant; Harmful by skin absorption; [Alfa Aesar MSDS] See Anisole and Hydroquinone dimethyl ether.

Hazard Classes and Categories · 2 件

Not Classified

Flammable liquids - Category 4

安全と保護具

Protective Action Criteria (PAC) · 3 件

3.0 [mg/m3]

32 [mg/m3]

190 [mg/m3]

安全データ

消防法: 危-4-3-III

化学と産業

薬理情報

Cellular LocationsCytoplasm

用途と製造

UsesUsed as a flavoring agent; [FDA]

Use Classification · 6 件

Fragrance Ingredients

Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes

Flavoring Agents -> JECFA Flavorings Index

Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes

General Manufacturing InformationBenzene, 1,3-dimethoxy-: ACTIVE

応用分野

使用1,3-Dimethoxybenzene-2,4,5,6-d4 (CAS# 362049-44-3) is a useful isotopically labeled research compound.

サプライヤー8 社

盐城通铭生物科技有限公司15195160625 · [email protected]

艾吉析科技（上海）有限公司17717235263 · [email protected]

Hunan Jibang Biological Technology Co., LTD13776644403 · [email protected]

玺标（上海）科技有限公司18512111473 18512111473 · [email protected]

成都思天德生物科技有限公司028-83243028 19136088901 · [email protected]

1,3-ジメトキシベンゼン-2,4,5,6-D4

基本情報

概要