L-Tyrosine, N-acetyl-3,5-diiodo-O-(4-methoxyphenyl)-, ethyl ester

HCID 10952191CAS 83249-56-3

기본 정보

표준 SMILES: CCOC(=O)[C@H](Cc1cc(I)c(Oc2ccc(OC)cc2)c(I)c1)NC(C)=O
InChIKey: LCJKMEUFNHSFPB-SFHVURJKSA-N
분자식: C20H21I2NO5
평균 분자량: 609.2 g/mol

이름 및 식별자

우선 이름: L-Tyrosine, N-acetyl-3,5-diiodo-O-(4-methoxyphenyl)-, ethyl ester
IUPAC: ethyl (2S)-2-acetamido-3-[3,5-diiodo-4-(4-methoxyphenoxy)phenyl]propanoate
영어명: Ethyl 2-(acetylamino)-3-[3,5-diiodo-4-(4-methoxyphenoxy)phenyl]propanoate
분자식: C20H21I2NO5
분자량: 609.19

이름 및 동의어

L-Tyrosine, N-acetyl-3,5-diiodo-O-(4-methoxyphenyl)-, ethyl esterRefChem:798169815-708-2SCHEMBL8745456LCJKMEUFNHSFPB-SFHVURJKSA-N(S)-N-acetyl-3,5-diiodo-4-p-methoxyphenoxyphenylalanine ethyl esterEthyl N-acetyl-3,5-diiodo-O-(4-methoxyphenyl)-L-TyrosinateAc-3,5-diiodo-4-(4-methoxyphenoxy)-Phe-OEtN-Acetyl-3,5-diiodo-O'-Methyl-L-Thyronine ethyl esterN-acetyl-O-(4-methoxyphenyl)-3,5-diiodo-L-tyrosine ethyl ester3,5-Diiodo-4-(p-methoxyphenoxy)-N-acetyl-L-phenylalanineethylester3,5-Diiodo-4-(4-methoxyphenoxy)-N-acetyl-L-phenylalanine ethyl ester

이름 더 보기

ethyl 2-acetamido-3-[3,5-diiodo-4-(4-methoxyphenoxy)phenyl]propanoateEthyl 2-(acetylamino)-3-[3,5-diiodo-4-(4-methoxyphenoxy)phenyl]propanoate2-acetamido-3-[3,5-diiodo-4-(4-methoxyphenoxy)phenyl]propionic acid ethyl ester

데이터베이스 식별자

CAS: 83249-56-3
PubChem CID: 10952191
EC Number: 815-708-2
Nikkaji: J963.053H

물성

구조 계산 물성

XLogP: 4.6
극성 표면적: 73.9 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 5
회전 가능 결합 수: 9
무거운 원자 수: 28
형식 전하: 0
복잡도: 501

물리화학적 성질

녹는점: 138 · 138-139 °C
끓는 점: 608 · 608.0±55.0 °C(Predicted)
밀도: 1.718 · 1.718-1.725g/cm3 at 20-20.2℃
증기압: 0.002 · 0.002-0.021Pa at 120-150℃
저장 조건: 2 · 2-8°C
산도 계수 (pKa): 14.51 · 14.51±0.46(Predicted)
LogP: 3.6 at · 3.6 at 25℃ and pH7

안전 및 규제

GHS 분류

GHS Classification · 3건

H413 (100%): May cause long lasting harmful effects to aquatic life [Hazardous to the aquatic environment, long-term hazard]

P273, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 2 reports by companies from 1 notifications to the ECHA C&L Inventory.

유해성 정보

Regulatory InformationStatus: Active Update: 25-09-2019 https://echa.europa.eu/registration-dossier/-/registered-dossier/29949

Hazard Classes and CategoriesAquatic Chronic 4 (100%)

안전 데이터

유해·위험 문구: 암호 유해·위험 문구 위험 등급 범주 신호 어 그림 문자 P- 코드 H413

화학 및 산업

상·하류 제품 정보

상류 원료

4-Methoxyphenylboronic acid N-Acetyl-3,5-diiodo-L-tyrosine ethyl ester

공급사11 곳

Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]

Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]

PT CHEM GROUP LIMITED+86-85511178; +86-85511178 · [email protected]

江苏艾康生物医药研发有限公司025-58859352 19370895928 · [email protected]

Hebei Conchain Biotech Co.,Ltd+86-13630830762 +86-13630830762 · [email protected]

연결된 노트

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