2-히드록시벤질알콜
Salicyl Alcohol
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기본 정보
- CAS
90-01-7- 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 물성보충 중
- 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
- 형식 전하
- 0
- 복잡도
- 83
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
- 산도 계수 (pKa)
- 1 · pK1:9.92 (25°C)
- 물리적 상태
- 결정질 플레이크 또는 분말
- 색상
- 라이트 베이지
- 수용성
- 67 g/L · 67g/L(22℃)
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
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
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
화학 및 산업
용도 및 제조
Uses
Used in phenol-formaldehyde resols; [Kanerva, p. 1815]
Plastic Composites Manufacturing [Category: Industry]
General Manufacturing InformationBenzenemethanol, 2-hydroxy-: ACTIVE
응용 분야
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
하류 제품
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