CAS 38059-78-8 4-amino-5-chloro-N-(2-(diethylamino)ethyl)-2-hydroxybenzamide hydrochloride (HCID 14116877)

기본 정보

CAS: 38059-78-8
표준 SMILES: CCN(CC)CCNC(=O)c1cc(Cl)c(N)cc1O.Cl
InChIKey: JXIGWAINVIWPQD-UHFFFAOYSA-N
분자식: C13H21Cl2N3O2
평균 분자량: 322.2 g/mol
단동위원소 질량: 321.10108227

이름 및 식별자

우선 이름: 4-amino-5-chloro-N-(2-(diethylamino)ethyl)-2-hydroxybenzamide hydrochloride
IUPAC: 4-amino-5-chloro-N-[2-(diethylamino)ethyl]-2-hydroxybenzamide;hydrochloride
현지명: O-데스메틸메토클로프라미드,염산염
영어명: O-DESMETHYL METOCLOPRAMIDE, HYDROCHLORIDE
분자식: C13H21Cl2N3O2
분자량: 322.23074

이름 및 동의어

4-amino-5-chloro-N-[2-(diethylamino)ethyl]-2-hydroxybenzamide hydrochloride4-amino-5-chloro-N-(2-(diethylamino)ethyl)-2-hydroxybenzamide hydrochlorideRefChem:517935892-816-638059-78-8O-Desmethyl Metoclopramide Hydrochloride4-amino-5-chloro-N-[2-(diethylamino)ethyl]-2-hydroxybenzamide;hydrochlorideMetoclopramide EP Impurity F HClJXIGWAINVIWPQD-UHFFFAOYSA-NO-DESMETHYL METOCLOPRAMIDE, HYDROCHLORIDESCHEMBL8746145DTXSID40556132

이름 더 보기

O-데스메틸메토클로프라미드,염산염Metoclopramide ImpurityClMetocloprFmide EP Impurity F HCl-DESMETHYL METOCLOPRAMIDE, HYDROCHLORIDEMetoclopramide EP Impurity F Hydrochloride4-AMino-5-chloro-N-[2-(diethylaMino)ethyl]-2-hydroxy-benzaMide Hydrochloride4-amino-5-chloro-N-(2-(diethylamino)ethyl)-2-hydroxybenzamide hydrogen chlorideMetoclopramide Impurity 6 Hydrochloride（Metoclopramide EP Impurity F Hydrochloride）

EBC-251212O-Desmethyl Metoclopramide (hydrochloride)CS-0138672EN300-18557466Z25749329994-amino-5-chloro-N-[2(diethylamino)ethyl]-2-hydroxybenzamide hydrochloride4-Amino-5-chloro-N-[2-(diethylamino)ethyl]-2-hydroxybenzamide Hydrochlorid4-amino-5-chloro-N-[2-(diethylamino)ethyl]2-hydroxybenzamide hydrochloride

물성

구조 계산 물성

극성 표면적: 78.6 Å²
수소 결합 공여자 수: 4
수소 결합 수용자 수: 4
회전 가능 결합 수: 6
무거운 원자 수: 20
형식 전하: 0
복잡도: 287

물리화학적 성질

녹는점: 237 · 237-239°C
저장 조건: -20 °C · -20°C Freezer
용해도: DMSO(약간 용해됨), 메탄올(약간 용해됨), 물(약간 용해됨)
물리적 상태: 고체
색상: 흰색에서 황백색까지

화학적 성질

White Powder

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.