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기본 정보
- CAS
34265-58-2- 표준 SMILES
CCOC(=O)c1cc(C)ccc1O- InChIKey
ZGYXABNSOOACGL-UHFFFAOYSA-N- 분자식
- C10H12O3
- 평균 분자량
- 180.203 g/mol
- 단동위원소 질량
- 180.07864424
이름 및 식별자
- 우선 이름
- Ethyl 5-methylsalicylate
- IUPAC
- Ethyl 2-hydroxy-5-methylbenzoate
- 현지명
- 에틸2-하이드록시-5-메틸벤조에이트
- 영어명
- ETHYL 2-HYDROXY-5-METHYLBENZOATE
- 분자식
- C10H12O3
- 분자량
- 180.2
이름 및 동의어
에틸2-하이드록시-5-메틸벤조에이트RARECHEM AL BI 0811ETHYL 5-METHYLSALICYLATEEthyl 5-methylsalicylate 98%2,5-Cresotic acid ethyl esterETHYL 2-HYDROXY-5-METHYLBENZOATEEthyl 6-hydroxy-3-methylbenzoate5-Methylsalicylic acid ethyl ester2-hydroxy-5-methyl-benzoicaciethylesterBenzoicacid,2-hydroxy-5-methyl-,ethylester2-hydroxy-5-methyl-benzoic acid ethyl ester
데이터베이스 식별자
- CAS
34265-58-2- PubChem CID
- 118629
- DTXSID
DTXSID7067827- UNII
- SQ76MR3LZV
- EC Number
- 251-903-3
- Nikkaji
- J287.888G
물성
물리화학적 성질
- 녹는점
- 2 ℃ · 2℃
- 끓는 점
- 251 °C · 251 °C(lit.)
- 밀도
- 1.103 g/mL · 1.103 g/mL at 25 °C(lit.)
- 굴절률
- 20 · n20/D 1.522(lit.)
- 인화점
- 98 °F · 98 °F
- 저장 조건
- RT, stored under nitrogen
- 산도 계수 (pKa)
- 10.23 · 10.23±0.18(Predicted)
- InChI
- 1S/C10H12O3/c1-3-13-10(12)8-6-7(2)4-5-9(8)11/h4-6,11H,3H2,1-2H3
- InChIKey
- ZGYXABNSOOACGL-UHFFFAOYSA-N
- SMILES
- CCOC(=O)c1cc(C)ccc1O
- EPA
- 2 · Benzoic acid, 2-hydroxy-5-methyl-, ethyl ester (34265-58-2)
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
안전 데이터
- wgk
- 3
- tsca
- TSCA listed
- ridadr
- UN 3272 3/PG 3
- risk_code
- 10-20/21/22-36/37/38
- hazard_code
- Xn
- safety_code
- 16-26-36
- Hazard Classifications
- Acute Tox. 4 DermalAcute Tox. 4 InhalationAcute Tox. 4 OralEye Irrit. 2Flam. Liq. 3Skin Irrit. 2STOT SE 3
- 스토리지 클래스
- 3 - Flammable liquids
화학 및 산업
응용 분야
일반 설명Ethyl 5-methylsalicylate (ethyl 2-hydroxy-5-methylbenzoate) is a hydroxyl benzoate derivative. One of the methods reported for its synthesis is the esterification of p-cresotinic acid with absolute alcohol. It is formed as an intermediate during the synthesis of 2-propoxy-5-methylbenzoic acid. Ethyl 2-hydroxy-5-methylbenzoate has been isolated as a minor by product in the AlCl3 promoted reaction of 2-methyl furan with ethyl propiolate.
공급사28 곳
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