메틸히드로퀴논

Methylhydroquinone

HCID 7253CAS 95-71-6
부분 구조 검색유사 구조 찾기

기본 정보

표준 SMILES
Cc1cc(O)ccc1O
InChIKey
CNHDIAIOKMXOLK-UHFFFAOYSA-N
분자식
C7H8O2
평균 분자량
124.14 g/mol
단동위원소 질량
124.0524295

개요

Toluquinol is a member of the class of hydroquinones that is hydroquinone in which one of the benzene hydrogens has been replaced by a methyl group. It has a role as an angiogenesis inhibitor, an anti-inflammatory agent and a Penicillium metabolite.

이름 및 식별자

우선 이름
Methylhydroquinone
IUPAC
2-methylbenzene-1,4-diol
현지명
메틸히드로퀴논
영어명
2-Methylhydroquinone
분자식
C7H8O2
분자량
124.14

이름 및 동의어

Methylhydroquinone95-71-62-Methylhydroquinone2-methylbenzene-1,4-diol2,5-DihydroxytolueneToluhydroquinonep-ToluhydroquinoneToluquinolp-Toluquinolp-ToluhydroquinolTolylhydroquinone2,5-Toluenediol
이름 더 보기
메틸히드로퀴논메틸하이드로퀴논2-메틸하이드로퀴논THQ
2-Methyl-1,4-benzenediol1,4-Benzenediol, 2-methyl-1,4-Dihydroxy-2-methylbenzene2-Methyl-1,4-hydroquinoneDTXSID4020876332W51E0OCNSC-4962DTXCID00876

데이터베이스 식별자

CAS
95-71-6
PubChem CID
7253
DTXSID
DTXSID4020876
ChEMBL
CHEMBL450917
ChEBI
CHEBI:133842
UNII
332W51E0OC
EC Number
202-443-7
Nikkaji
J4.712K

물성

구조 계산 물성

XLogP
1
극성 표면적
40.5 Ų
수소 결합 공여자 수
2
수소 결합 수용자 수
2
회전 가능 결합 수
0
무거운 원자 수
9

실험 및 물리화학적 성질

Chemical ClassesOther Classes -> Phenols
Vapor Pressure0.0028 [mmHg]
Physical Description · 2건

Dry Powder

Off-white solid with a slight odor; [Eastman Chemical MSDS]

물리화학적 성질

녹는점
128 · 128-130 °C(lit.)
끓는 점
285 °C · 285°C
밀도
1.1006 · 1.1006 (rough estimate)
증기압
0.004 Pa · 0.004Pa at 25℃
굴절률
1.4922 · 1.4922 (estimate)
인화점
172 °C · 172 °C

화학적 성질

white solid

안전 및 규제

GHS 분류

GHS Classification · 5건

This chemical does not meet GHS hazard criteria for 1.1% (5 of 467) of reports.

Danger

H302 (94%): Harmful if swallowed [Warning Acute toxicity, oral]

P203, P261, P264, P264+P265, P270, P271, P272, P273, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P305+P354+P338, P317, P318, P319, P321, P330, P332+P317, P333+P317, P337+P317, P362+P364, P391, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 467 reports by companies from 28 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Regulatory Information · 4건

Chemical: 1,4-Benzenediol, 2-methyl-

1,4-Benzenediol, 2-methyl- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 1,4-Benzenediol, 2-methyl- are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)

Status: Active Update: 05-01-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/27614

Methylhydroquinone: Does not have an individual approval but may be used under an appropriate group standard

Hazards SummaryA skin and eye irritant; Dust causes eye and respiratory tract irritation; Harmful by ingestion; [Eastman Chemical MSDS] See Hydroquinone.
Hazard Classes and CategoriesAcute Tox. 4 (94%)

안전 데이터

wgk
2
tsca
TSCA listed
rtecs
MX6700000
ridadr
2811
독성
LD50 orally in Rabbit: 200 - 400 mg/kg
HS 번호
29072900

화학 및 산업

용도 및 제조

UsesUsed as an inhibitor; [Eastman Chemical MSDS]
U.S. Production2023: 22,046 lb
Industry UsesCorrosion inhibitor
General Manufacturing Information · 2건

All Other Chemical Product and Preparation Manufacturing

1,4-Benzenediol, 2-methyl-: ACTIVE

응용 분야

용도Antioxidant, polymerization inhibitor.

일반 설명Methylhydroquinone is produced by the oxidation of o-cresol by the mutants G103S, G103S/A107G, and G103S/A107T.

상·하류 제품 정보

공급사50 곳

国药集团化学试剂有限公司86-21-63210123 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
衢州润东化工有限公司0570-8789886 18892685668 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
韶远科技（上海）有限公司021-50795510 4000665055 · [email protected]

추가 설명

정의ChEBI: A member of the class of hydroquinones that is hydroquinone in which one of the benzene hydrogens has been replaced by a methyl group.

관련 반응

67건
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