Isotridecan-1-ol (HCID 33865)

이름 및 식별자

우선 이름: Isotridecan-1-ol
IUPAC: 11-methyldodecan-1-ol
현지명: 11-메틸도데칸올
영어명: 11-methyldodecanol
분자식: C13H28O
분자량: 200.36

이름 및 동의어

Isotridecan-1-olRefChem:15006811-MethyldodecanolIsotridecanol11-methyldodecan-1-olISOTRIDECYL ALCOHOL85763-57-127458-92-0Iso-Tridecyl-alcohol11-Methyl-1-dodecanolIsotridecanol-VX3T72M5SG

이름 더 보기

11-메틸도데칸올

Alcohols, C11-14-isoalcohols, C13-rich11-Methyl-1-dodecanol;1-Dodecanol, 11-methyl-FIXATEUR ITCEINECS 248-469-2UNII-VX3T72M5SGEINECS 288-581-9EC 248-469-2

데이터베이스 식별자

CAS: 27458-92-0、68526-86-3、85763-57-1
PubChem CID: 33865
DTXSID: DTXSID7058676
ChEBI: CHEBI:77438
UNII: VX3T72M5SG
EC Number: 248-469-2、288-581-9
Nikkaji: J94.650H

물성

구조 계산 물성

XLogP: 5.4
극성 표면적: 20.2 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 1
회전 가능 결합 수: 10
무거운 원자 수: 14
형식 전하: 0
복잡도: 99

실험 및 물리화학적 성질

Physical DescriptionLiquid

물리화학적 성질

끓는 점: 86 · 86-88 °C(Press: 0.2 Torr)
밀도: 0.831 · 0.831±0.06 g/cm3(Predicted)
저장 조건: Room Temperature, under inert atmosphere
용해도: 클로로포름(약간 용해됨), 메탄올(약간 용해됨)
산도 계수 (pKa): 15.2 · 15.20±0.10(Predicted)
물리적 상태: 고체
색상: 흰색에서 황백색까지
LogP: 5.47 · 5.470 (est)

안전 및 규제

GHS 분류

GHS Classification · 6건

This chemical does not meet GHS hazard criteria for 3.5% (178 of 5060) of reports.

Warning

H315 (87.6%): Causes skin irritation [Warning Skin corrosion/irritation]；H400 (95.3%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard]；H410 (92.1%): Very toxic to aquatic life with long lasting effects [Warning Hazardous to the aquatic environment, long-term hazard]

P264, P273, P280, P302+P352, P321, P332+P317, P362+P364, P391, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 5060 reports by companies from 15 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Reported as not meeting GHS hazard criteria per 178 of 5060 reports by companies.；There are 14 notifications provided by 4882 of 5060 reports by companies with hazard statement code(s).；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 · 4건

Chemical: Isotridecanol

Isotridecanol is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Isotridecanol 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: 30-06-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/2154

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

Hazard Classes and CategoriesSkin Irrit. 2 (87.6%)；Aquatic Acute 1 (95.3%)；Aquatic Chronic 1 (92.1%)

규제 정보

Regulatory Information · 4건

Chemical: Isotridecanol

Isotridecanol is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Isotridecanol 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: 30-06-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/2154

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

안전 데이터

신호 어: Warning
유해·위험 문구: 암호 유해·위험 문구 위험 등급 범주 신호 어 그림 문자 P- 코드 H302

화학 및 산업

용도 및 제조

U.S. Production2023: 5,000,000 - <10,000,000 lb；2022: 5,000,000 - <10,000,000 lb；2021: 5,000,000 - <10,000,000 lb；2020: 5,000,000 - <10,000,000 lb

Consumer UsesNot Known or Reasonably Ascertainable

Industry UsesSurfactant (surface active agent)；Lubricating agent；Intermediate

Household ProductsInformation on 2 consumer products that contain Isotridecanol in the following categories is provided:；• Inside the Home

Use ClassificationFragrance Ingredients

General Manufacturing Information · 2건

Petrochemical Manufacturing；Wholesale and Retail Trade；Soap, Cleaning Compound, and Toilet Preparation Manufacturing；Pesticide, Fertilizer, and Other Agricultural Chemical Manufacturing

Isotridecanol: ACTIVE

응용 분야

용도11-Methyldodecanol in one of the Me-substituted dedecanols tested for growth-inhibitory action against 5 virulent strains of human Mycobacterium tuberculosis.