3-Methyl-4-(methylthio)phenol (HCID 18391)

이름 및 식별자

우선 이름: 3-Methyl-4-(methylthio)phenol
IUPAC: 3-methyl-4-methylsulfanylphenol
영어명: 3-Methyl-4-(methylthio)phenol
분자식: C8H10OS
분자량: 154.23

이름 및 동의어

3-Methyl-4-(methylthio)phenol3120-74-94-(Methylthio)-m-cresolMethylthiomethylphenolPhenol, 3-methyl-4-(methylthio)-3-Methyl-4-(1-methylthio)phenolDTXSID0051996304RF69F8FNSC-87560DTXCID3030559RefChem:818724221-496-7

이름 더 보기

P-METHYLMERCAPTO-M-CRESOLMTMCusafma-17Methylthiomcresolp-Methylthio-m-cresol4-(methylthio)-m-cresoFenamiphos Impurity 3

MMTP3-Methyl-4-(methylsulfanyl)phenol3-methyl-4-methylsulfanylphenolUSAF MA-174-(Methylthio)-3-methylphenolm-CRESOL, 4-(METHYLTHIO)-MFCD00045773NSC 87560

데이터베이스 식별자

CAS: 3120-74-9
PubChem CID: 18391
DTXSID: DTXSID0051996
ChEMBL: CHEMBL3560322
ChEBI: CHEBI:38681
UNII: 304RF69F8F
EC Number: 221-496-7、467-290-2
Nikkaji: J48.511J

물성

구조 계산 물성

XLogP: 2.5
극성 표면적: 45.5 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 2
회전 가능 결합 수: 1
무거운 원자 수: 10
형식 전하: 0
복잡도: 105

물리화학적 성질

녹는점: 56 · 56-60 °C
끓는 점: 151 °C · 151 °C / 15mmHg
밀도: 1.1125 · 1.1125 (rough estimate)
굴절률: 1.53 · 1.5300 (estimate)
저장 조건: Room Temperature
용해도: 클로로포름, 메탄올에 용해됨
물리적 상태: 고체
산도 계수 (pKa): 9.9 · 9.90±0.18(Predicted)
색상: 미색부터 밝은 베이지까지
BRN: 1210322 · 1210322
InChI: 1S/C8H10OS/c1-6-5-7(9)3-4-8(6)10-2/h3-5,9H,1-2H3
InChIKey: VKALYYFVKBXHTF-UHFFFAOYSA-N
SMILES: CSc1ccc(O)cc1C
EPA: 4 · 4-(Methylthio)-m-cresol (3120-74-9)

안전 및 규제

GHS 분류

GHS Classification · 6건

Danger

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H318 (86.7%): Causes serious eye damage [Danger Serious eye damage/eye irritation]；H319 (13.3%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (95.6%): 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, P305+P354+P338, P317, 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 45 reports by companies from 5 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.

유해성 정보

Regulatory Information · 3건

Phenol, 3-methyl-4-(methylthio)- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Phenol, 3-methyl-4-(methylthio)- 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: 16-04-2013 https://echa.europa.eu/registration-dossier/-/registered-dossier/11712

Status: Active Update: 18-01-2017 https://echa.europa.eu/registration-dossier/-/registered-dossier/18920

Hazard Classes and Categories · 3건

Skin Irrit. 2 (100%)；Eye Dam. 1 (86.7%)；Eye Irrit. 2 (13.3%)；STOT SE 3 (95.6%)

Flam. Liq. 3 (100%)；Acute Tox. 4 (100%)；Skin Irrit. 2 (100%)；Skin Sens. 1 (100%)

Acute toxicity (Dermal) - Category 3；Skin corrosion/irritation - Category 2；Serious eye damage/eye irritation - Category 2A；Hazardous to the aquatic environment (Acute) - Category 3；Hazardous to the aquatic environment (Long-term) - Category 3

규제 정보

Regulatory Information · 3건

Phenol, 3-methyl-4-(methylthio)- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Phenol, 3-methyl-4-(methylthio)- 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: 16-04-2013 https://echa.europa.eu/registration-dossier/-/registered-dossier/11712

Status: Active Update: 18-01-2017 https://echa.europa.eu/registration-dossier/-/registered-dossier/18920

안전 데이터

wgk: 3
tsca: TSCA listed
rtecs: GP2225000
ridadr: 3335
HS 번호: 2930909899
risk_code: 22-37/38-41
hazard_code: Xn,Xi
safety_code: 26-36/39
위험 등급: IRRITANT, STENCH
기존화학 물질: 2015-3-6566
Hazard Classifications: Eye Dam. 1Skin Irrit. 2STOT SE 3
스토리지 클래스: 11 - Combustible Solids

화학 및 산업

용도 및 제조

U.S. Production2021: 163,802 lb；2020: 172,466 lb

General Manufacturing InformationPhenol, 3-methyl-4-(methylthio)-: ACTIVE

응용 분야

용도3-Methyl-4-(methylthio)phenol is a metabolite of Fenamiphos (F245700), a Systemic broad spectrum nematocide with anticholinesterase activity. Nematocide.

상·하류 제품 정보

상류 원료

하류 제품

펜티온 페나미포스

공급사50 곳

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]

郑州阿尔法化工有限公司+86-18530059196 · [email protected]

衢州润东化工有限公司0570-8789886 18892685668 · [email protected]

湖北永阔科技有限公司027-59223108 15972152991 · [email protected]

湖北万得化工有限公司15377098680 15377098680 · [email protected]

연결된 노트

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3-Methyl-4-(methylthio)phenol

기본 정보