2-히드록시벤질알콜

Salicyl Alcohol

HCID 5146CAS 90-01-7
부분 구조 검색유사 구조 찾기

기본 정보

표준 SMILES
OCc1ccccc1O
InChIKey
CQRYARSYNCAZFO-UHFFFAOYSA-N
분자식
C7H8O2
평균 분자량
124.14 g/mol
단동위원소 질량
124.0524295

개요

Salicyl alcohol is a hydroxybenzyl alcohol that is phenol substituted by a hydroxymethyl group at C-2. It has a role as a human urinary metabolite. It is a hydroxybenzyl alcohol and an aromatic primary alcohol. It is functionally related to a phenol and a benzyl alcohol.

이름 및 식별자

우선 이름
Salicyl Alcohol
IUPAC
2-(hydroxymethyl)phenol
현지명
2-히드록시벤질알콜
영어명
2-Hydroxybenzyl alcohol
분자식
C7H8O2
분자량
124.14

이름 및 동의어

salicyl alcohol2-HYDROXYBENZYL ALCOHOL90-01-72-(Hydroxymethyl)phenolSaligenino-Hydroxybenzyl alcoholBenzenemethanol, 2-hydroxy-SaligenolDiathesinSalicylalkoholSalicainDTXSID9045843
이름 더 보기
2-하이드록시벤질알코올2-히드록시벤질알콜2-하이드록시벤질 알코올2-하이드록시벤질알콜Salicylic alcohol1‐(2‐Hydroxyphenyl)‐methanolSALIGENINEα,2-toluenediolo-Methylolphenol
NSC-3814FA1N0842KBCHEBI:16464DTXCID70258432-methylol phenol2-monomethylolphenolRefChem:884386201-960-5

데이터베이스 식별자

CAS
90-01-7
PubChem CID
5146
DTXSID
DTXSID9045843
ChEMBL
CHEMBL280802
ChEBI
CHEBI:16464
UNII
FA1N0842KB
EC Number
201-960-5
Nikkaji
J4.312E

물성

구조 계산 물성

XLogP
0.7
극성 표면적
40.5 Ų
수소 결합 공여자 수
2
수소 결합 수용자 수
2
회전 가능 결합 수
1
무거운 원자 수
9

실험 및 물리화학적 성질

Chemical ClassesOther Classes -> Phenols
LogP0.56
Vapor Pressure0.000825 [mmHg]
Food Contact SubstancesFCS -> FDA Inventory of Food Contact Substances Listed in 21 CFR
Physical DescriptionSolid

물리화학적 성질

녹는점
83 · 83-85 °C(lit.)
끓는 점
190.92 °C · 190.92°C (rough estimate)
밀도
1 · 1,613 g/cm3
굴절률
1.5035 · 1.5035 (estimate)
저장 조건
30 °C · Store below +30°C.
용해도
5 %, · 에탄올: 용해성 5%, 투명하거나 매우 약간 흐릿함, 무색 내지 연황색

화학적 성질

light brown crystalline powder

안전 및 규제

GHS 분류

GHS Classification · 5건

This chemical does not meet GHS hazard criteria for 35.2% (37 of 105) of reports.

Warning

H315 (64.8%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, 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 105 reports by companies from 9 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Regulatory Information · 2건

Chemical: Benzenemethanol, 2-hydroxy-

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

Hazards SummaryAllergic contact dermatitis reported in resin handlers; The other methylol phenols are also sensitizers: 3-methylol phenol (620-24-6) and 4-methylol phenol (623-05-2). [Kanerva, p. 1815]
Hazard Classes and CategoriesSkin Irrit. 2 (64.8%)

독성 정보

Adverse EffectsSkin Sensitizer - An agent that can induce an allergic reaction in the skin.

안전 데이터

wgk
3
tsca
TSCA listed
rtecs
DO6430000
HS 번호
29072900
risk_code
36/37/38
hazard_code
Xi

화학 및 산업

용도 및 제조

Uses · 2건

Used in phenol-formaldehyde resols; [Kanerva, p. 1815]

Plastic Composites Manufacturing [Category: Industry]

General Manufacturing InformationBenzenemethanol, 2-hydroxy-: ACTIVE
응용 분야 · 2건

용도2-Hydroxybenzyl Alcohol is a phenolic component of a part of a salix bark extract which maintains a minor anti-depressant effect. Phenolic analog with potential for anti-melanomic effect. Also It is an intermediate in the production of phenol formaldehyde res ins (may remain after condensation of the resin); sensitizer in phenol-formaldehyde resins; in loeal anesthetics.

일반 설명2-Hydroxybenzyl alcohol participates in the selective ring opening reaction of 4H-1,3,2-benzodioxasilines.

상·하류 제품 정보

상류 원료

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]
科瑞迪化学400-821-5857 021-64326257 · [email protected]

추가 설명

정의ChEBI: A hydroxybenzyl alcohol that is phenol substituted by a hydroxymethyl group at C-2.

관련 반응

87건
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