Tyrosine ethyl ester hydrochloride

HCID 2724939CAS 4089-07-0

기본 정보

표준 SMILES: CCOC(=O)[C@@H](N)Cc1ccc(O)cc1.Cl
InChIKey: BQULAXAVRFIAHN-PPHPATTJSA-N
분자식: C11H16ClNO3
평균 분자량: 245.7 g/mol
단동위원소 질량: 245.08187105

이름 및 식별자

우선 이름: Tyrosine ethyl ester hydrochloride
IUPAC: ethyl (2S)-2-amino-3-(4-hydroxyphenyl)propanoate;hydrochloride

이름 및 동의어

4089-07-0L-Tyrosine ethyl ester hydrochlorideEthyl L-tyrosinate hydrochlorideTYROSINE ETHYL ESTER HYDROCHLORIDEFAP58DAZ1ETyrosine Ethyl Ester HCLEthyl tyrosinate hydrochlorideL-Tyrosine, ethyl ester, hydrochlorideL-TYROSINE ETHYLESTER MONOHYDROCHLORIDEEINECS 223-820-2NSC-17141Tyrosine, ethyl ester, hydrochloride, L-

이름 더 보기

Tyrosine, L-, ethyl ester, hydrochlorideNSC 17141(s)-tyrosine ethyl ester hydrochlorideL-Tyrosine ethylester monohydrochloride (JAN)(S)-(-)-TYROSINE ETHYL ESTER HYDROCHLORIDEL-TYROSINE ETHYLESTER MONOHYDROCHLORIDE [JAN]L-TYROSINE, ETHYL ESTER, HYDROCHLORIDE (1:1)Tyrosine ethyl ester HCl (9CI)

데이터베이스 식별자

CAS: 4089-07-0
PubChem CID: 2724939
DTXSID: DTXSID401351454
ChEMBL: CHEMBL2107700
UNII: FAP58DAZ1E
EC Number: 223-820-2

물성

구조 계산 물성

극성 표면적: 72.6 Å²
수소 결합 공여자 수: 3
수소 결합 수용자 수: 4
회전 가능 결합 수: 5
무거운 원자 수: 16
형식 전하: 0
복잡도: 200

실험 및 물리화학적 성질

Food AdditivesUse unspecified -> FDA Substance added to food

안전 및 규제

GHS 분류

GHS Classification · 5건

This chemical does not meet GHS hazard criteria for 28.6% (2 of 7) of reports.

Warning

H315 (71.4%): 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 7 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.