P-티몰

3-Methyl-4-isopropylphenol

HCID 18597
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기본 정보

CAS
3228-02-2
표준 SMILES
Cc1cc(O)ccc1C(C)C
InChIKey
IJALWSVNUBBQRA-UHFFFAOYSA-N
분자식
C10H14O
평균 분자량
150.22 g/mol
단동위원소 질량
150.10446507

개요

4-Isopropyl-3-methylphenol is an alkylbenzene.

이름 및 식별자

우선 이름
3-Methyl-4-isopropylphenol
IUPAC
3-methyl-4-propan-2-ylphenol
현지명
P-티몰
영어명
3-methyl-4-propan-2-ylphenol
분자식
C10H14O
분자량
150.22

이름 및 동의어

4-Isopropyl-3-methylphenol3228-02-23-Methyl-4-isopropylphenolo-CYMEN-5-OL3-methyl-4-propan-2-ylphenol3-Methyl-4-(1-methylethyl)phenolH41B6Q1I9LNORO-X Foaming HandSoapNSC-62111DTXCID20108517DTXSID10186026RefChem:55740
이름 더 보기
P-티몰o-사이멘-5-올4-아이소프로필-m-크레솔4-이소프로필-3-메틸페놀4-Isopropyl-2-methylphenol2-Methyl-4-isopropylphenolbiosal(antibacterial)4-Isopropyl-3-Methylphenol, 99.0%(GC)frecide
Biosol4-Isopropyl-m-cresolp-ThymolPhenol, 3-methyl-4-(1-methylethyl)-o-Cymen-5y-ol3-methyl-4-(propan-2-yl)phenolMFCD00010704isopropylmethylphenol

데이터베이스 식별자

CAS
3228-02-2
PubChem CID
18597
DTXSID
DTXSID10186026
ChEBI
CHEBI:34429
UNII
H41B6Q1I9L
EC Number
221-761-7
Nikkaji
J30.641J

물성

구조 계산 물성

XLogP
3
극성 표면적
20.2 Ų
수소 결합 공여자 수
1
수소 결합 수용자 수
1
회전 가능 결합 수
1
무거운 원자 수
11

실험 및 물리화학적 성질

Cosmetics · 2건

Cosmetic ingredients (o-Cymen-5-ol) -> CIR (Cosmetic Ingredient Review)

Preservative

FragrancesFragrance Ingredient (Phenol, 3-methyl-4-(1-methylethyl)-) -> IFRA transparency List

물리화학적 성질

녹는점
111 · 111-114 °C(lit.)
끓는 점
246 °C · 246 °C
밀도
0.9688 · 0.9688 (estimate)
증기압
1.81 Pa · 1.81Pa at 25℃
굴절률
1.5115 · 1.5115 (estimate)
저장 조건
Sealed in dry,Room Temperature

화학적 성질

White crystal powder

안전 및 규제

GHS 분류

GHS Classification · 6건

This chemical does not meet GHS hazard criteria for 22.8% (37 of 162) of reports.

Danger

H315 (30.2%): Causes skin irritation [Warning Skin corrosion/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 162 reports by companies from 12 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Danger

유해성 정보

Regulatory Information · 3건

Chemical: 3-methyl-4-(1-methylethyl) phenol

Status: Active Update: 08-02-2021 https://echa.europa.eu/registration-dossier/-/registered-dossier/16688

Phenol, 3-methyl-4-(1-methylethyl)-: Does not have an individual approval but may be used under an appropriate group standard

Other Safety InformationIMAP assessments - 3-methyl-4-(1-methylethyl) phenol: Human health tier II assessment
Hazard Classes and Categories · 3건

Skin Irrit. 2 (30.2%)

Eye irritation - category 2A

Serious eye damage/eye irritation - Category 1

독성 정보

Toxicity Summary · 2건

The CIR Expert panel concludes Sodium p-Chloro-m-Cresol, p-Chloro-m-Cresol, Chlorothymol, m-Cresol, o-Cresol, Isopropyl Cresols, Thymol, o-Cymen-5-ol, Cavacrol are safe at concentrations up to 0.5% in cosmetics; however, the available data are insufficient to support the safety of p-Cresol and Mixed Cresols for use in cosmetic products.

Safe for use in cosmetics, with qualifications

안전 데이터

wgk
2
rtecs
GZ7170000
ridadr
1759
HS 번호
29071990
risk_code
36/37/38
hazard_code
Xi

화학 및 산업

용도 및 제조

UsesCIR ingredient: o-Cymen-5-ol
Use Classification · 2건

Fragrance Ingredients

Cosmetics -> Preservative

응용 분야

용도Isopropylmethylphenol is a useful reagent for the cross-coupling reactions.

상·하류 제품 정보

공급사100 곳

国药集团化学试剂有限公司86-21-63210123 · [email protected]
北京华美互利生物化工010-56205725 · [email protected]
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]
Shandong chuangyingchemical Co., Ltd.18853181302 · [email protected]

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