라우릴글라이콜

1,2-Dodecanediol

HCID 92866CAS 1119-87-5

기본 정보

표준 SMILES: CCCCCCCCCCC(O)CO
InChIKey: ZITKDVFRMRXIJQ-UHFFFAOYSA-N
분자식: C12H26O2
평균 분자량: 202.33 g/mol
단동위원소 질량: 202.19328007

개요

1,2-dodecanediol is a medium-chain primary fatty alcohol that is dodecane carrying hydroxy groups at positions 1 and 2. It has a role as an antibacterial agent and an antifungal agent. It is a medium-chain primary fatty alcohol, a secondary fatty alcohol and a dodecanediol.

이름 및 식별자

우선 이름: 1,2-Dodecanediol
IUPAC: dodecane-1,2-diol
현지명: 라우릴글라이콜
영어명: 1,2-Dodecanediol
분자식: C12H26O2
분자량: 202.33

이름 및 동의어

1,2-DodecanediolDodecane-1,2-diol1,2-DihydroxydodecaneLauryl glycolEMM0U4H102EINECS 214-289-8UNII-EMM0U4H102N-DODECANE-1,2-DIOL1,2-DODECYLENE GLYCOL2-HYDROXYLAURYL ALCOHOLMEXANYL GUNSC 25930

이름 더 보기

라우릴글라이콜1,2-도데칸디올Dodecanedioldodecane-1,laurylglycolauryl glycol1,2-Dodecandiol1,2-Dodecanediol>1,2-Dodecanediol 90%1,2-DODECANEDIOL 95+%

NSC-25930LAURYL GLYCOL [INCI]AI3-13236DTXSID30862552RefChem:72048(+-)-LAURYL GLYCOLDTXCID20811296LAURYL GLYCOL, (+-)-

데이터베이스 식별자

CAS: 1119-87-5
PubChem CID: 92866
DTXSID: DTXSID30862552
ChEBI: CHEBI:228133
UNII: EMM0U4H102
EC Number: 214-289-8
Nikkaji: J203.345C

물성

구조 계산 물성

XLogP: 4
극성 표면적: 40.5 Å²
수소 결합 공여자 수: 2
수소 결합 수용자 수: 2
회전 가능 결합 수: 10
무거운 원자 수: 14
형식 전하: 0
복잡도: 104

실험 및 물리화학적 성질

Cosmetics · 2건

Cosmetic ingredients (Lauryl Glycol) -> CIR (Cosmetic Ingredient Review)

Emollient; Antistatic; Skin conditioning; Hair conditioning

물리화학적 성질

녹는점: 56 · 56-60 °C (lit.)
끓는 점: 280.32 °C · 280.32°C (rough estimate)
밀도: 0.9216 · 0.9216 (rough estimate)
굴절률: 1.4617 · 1.4617 (estimate)
저장 조건: Sealed in dry,Room Temperature
물리적 상태: powder to crystaline
산도 계수 (pKa): 14.46 · 14.46±0.20(Predicted)
색상: 흰색에서 거의 흰색
BRN: 1700179 · 1700179
화장품 원료 기능: 피부 컨디셔닝 - 보습제피부 컨디셔닝대전방지제헤어 컨디셔닝
InChI: InChI=1S/C12H26O2/c1-2-3-4-5-6-7-8-9-10-12(14)11-13/h12-14H,2-11H2,1H3
InChIKey: ZITKDVFRMRXIJQ-UHFFFAOYSA-N
SMILES: C(O)C(O)CCCCCCCCCC
LogP: 3.577 · 3.577 (est)
EPA: 1 · 1,2-Dodecanediol (1119-87-5)

안전 및 규제

GHS 분류

GHS Classification · 5건

This chemical does not meet GHS hazard criteria for 15.9% (25 of 157) of reports.

Warning

H319 (84.1%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]

P264+P265, P280, P305+P351+P338, and P337+P317 (click each P-code to see the statement)

Aggregated GHS information provided per 157 reports by companies from 2 notifications to the ECHA C&L Inventory.

유해성 정보

Regulatory Information · 3건

Chemical: 1,2-Dodecanediol

PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.

1,2-Dodecanediol: Does not have an individual approval but may be used under an appropriate group standard

Hazard Classes and CategoriesEye Irrit. 2 (84.1%)

독성 정보

Toxicity SummarySafe in the present practices of use and concentration. Ingredient, concentration, and use information are available in documents discoverable at https://cir-reports.cir-safety.org

안전 데이터

wgk: 1
tsca: TSCA listed
HS 번호: 2905.39.9000
safety_code: 22-24/25
기존화학 물질: KE-12844
스토리지 클래스: 11 - Combustible Solids

화학 및 산업

용도 및 제조

UsesCIR ingredient: Lauryl Glycol

Use ClassificationCosmetics -> Emollient; Antistatic; Skin conditioning; Hair conditioning

General Manufacturing Information1,2-Dodecanediol: ACTIVE

응용 분야

용도1,2-Dodecanediol was used in the preparation of:lipophilic diamines and amino alcoholsFe(II), Co(II) and Ni(II) ferrite nanoparticles in the range of 9-25 nm