2-(4-히드록시페녹시)프로피온산메틸에스테르

Propanoic acid, 2-(4-hydroxyphenoxy)-, methyl ester

HCID 366926CAS 60075-04-9

부분 구조 검색 유사 구조 찾기

기본 정보

표준 SMILES: COC(=O)C(C)Oc1ccc(O)cc1
InChIKey: UUYSCNGPNOYZMC-UHFFFAOYSA-N
분자식: C10H12O4
평균 분자량: 196.2 g/mol
단동위원소 질량: 196.07355886

이름 및 식별자

우선 이름: Propanoic acid, 2-(4-hydroxyphenoxy)-, methyl ester
IUPAC: methyl 2-(4-hydroxyphenoxy)propanoate
현지명: 2-(4-히드록시페녹시)프로피온산메틸에스테르
영어명: 2-(4-Hydroxyphenoxy)propionic acid methyl ester
분자식: C10H12O4
분자량: 196.2

이름 및 동의어

60075-04-9Propanoic acid, 2-(4-hydroxyphenoxy)-, methyl esterRefChem:374713Methyl 2-(4-hydroxyphenoxy)propanoatemethyl 2-(4-hydroxyphenoxy)propionateNSC6360902-(4-Hydroxyphenoxy)propionic acid methyl esterMFCD00204480Propanoic acid,2-(4-hydroxyphenoxy)-, methyl esterPropanoic acid, 2-(4-hydroxyphenoxy)-, methyl ester; 2-(4-Hydroxyphenoxy)propionic acid methyl ester; 2-(4-Hydroxyphenoxy)propanoic acid methyl ester; Methyl 2-(4-hydroxyphenoxy)propanoate; Methyl 2-(4-hydroxyphenoxy)propionateSCHEMBL1931468SCHEMBL7697084

이름 더 보기

2-(4-히드록시페녹시)프로피온산메틸에스테르Gingerol Impurity 2Methylparaben Impurity 15UUYSCNGPNOYZMC-UHFFFAOYSA-N(RS)-methyl 2-(4-hydroxyphenoxy)propionate2-(4-HYDROXY-PHENOXY)PROPIONIC ACID METHYL ESTER

CHEMBL1965216DTXSID001225645WEA21026Methyl2-(4-hydroxyphenoxy)propanoatemethyl 2-(p-hydroxyphenoxy)propionateAKOS005089604NSC-636090SB44725

데이터베이스 식별자

CAS: 60075-04-9
PubChem CID: 366926
DTXSID: DTXSID001225645
ChEMBL: CHEMBL1965216
Nikkaji: J446.524E

물성

구조 계산 물성

XLogP: 1.9
극성 표면적: 55.8 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 4
회전 가능 결합 수: 4
무거운 원자 수: 14
형식 전하: 0
복잡도: 185

물리화학적 성질

끓는 점: 139 · 139-142 °C(Press: 0.29 Torr)
밀도: 1.187 · 1.187±0.06 g/cm3(Predicted)
산도 계수 (pKa): 10.07 · 10.07±0.15(Predicted)

안전 및 규제

안전 데이터

HS 번호: 2918999090

화학 및 산업

응용 분야

용도Methyl 2-(4-Hydroxyphenoxy)propionate is an intermediate in the synthesis of (±)-Fluazifop (F407430), a grass-selective herbicide which inhibits acetyl-CoA carboxylase in sensitive plant species.