아미노아세톤수소화물

2-Propanone, 1-amino-, hydrochloride

HCID 3084025

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 7737-17-9
표준 SMILES: CC(=O)CN.Cl
InChIKey: RUCLDQBBIJKQHO-UHFFFAOYSA-N
분자식: C3H8ClNO
평균 분자량: 109.55 g/mol
단동위원소 질량: 109.02944156

이름 및 식별자

우선 이름: 2-Propanone, 1-amino-, hydrochloride
IUPAC: 1-aminopropan-2-one;hydrochloride
현지명: 아미노아세톤수소화물
영어명: Aminoacetone hydrochloride
분자식: C3H8ClNO
분자량: 109.55472

이름 및 동의어

Aminoacetone hydrochloride7737-17-92-Propanone, 1-amino-, hydrochlorideDTXSID80228088RefChem:557529DTXCID00150579231-798-01-aminopropan-2-one hydrochloride1-Aminoacetone hydrochlorideAminoacetone HCl1-AMINOPROPAN-2-ONE HCL1-aminopropan-2-one;hydrochloride

이름 더 보기

아미노아세톤수소화물2-OxopropylaMMoniuM Chloride1-Aminoacetone hydrochloride, >=95%2-Propanone, 1-aMino-,hydrochloride (8CI,9CI)AMINOACETONE HYDROCHLORIDE ISO 9001：2015 REACH

MFCD00056125Aminoacetone (hydrochloride)EINECS 231-798-01-aminopropan-2-one hydrochloride saltSCHEMBL10279511-Amino-2-propanone hydrochlorideNSC 159195PB43448

데이터베이스 식별자

CAS: 7737-17-9
PubChem CID: 3084025
DTXSID: DTXSID80228088
EC Number: 231-798-0

물성

구조 계산 물성

극성 표면적: 43.1 Å²
수소 결합 공여자 수: 2
수소 결합 수용자 수: 2
회전 가능 결합 수: 1
무거운 원자 수: 6
형식 전하: 0
복잡도: 42.2

물리화학적 성질

녹는점: 73 · 73-74 °C
저장 조건: 2 · Inert atmosphere,2-8°C
용해도: 25 mg/ml; · DMF: 25 mg/ml; DMSO: 15 mg/ml; Ethanol: 10 mg/ml; PBS (pH 7.2): 10 mg/ml
물리적 상태: 결정성 고체
색상: Off-white to yellow
안정성: 흡습성
InChI: InChI=1S/C3H7NO.ClH/c1-3(5)2-4;/h2,4H2,1H3;1H
InChIKey: RUCLDQBBIJKQHO-UHFFFAOYSA-N
SMILES: C(=O)(C)CN.Cl

화학적 성질

White to Off-White Solid

안전 및 규제

GHS 분류

GHS Classification · 4건

Danger

H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P305+P354+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Hazard Classes and CategoriesAcute Tox. 4 (50%)

안전 데이터

wgk: WGK 3
Hazard Classifications: Eye Dam. 1
스토리지 클래스: 11 - Combustible Solids

화학 및 산업

응용 분야 · 1건

개요Aminoacetone is a threonine and glycine catabolite that can be converted to methylglyoxal by amine oxidases. It has been identified as one of several endogenous sources of methylglyoxal found in the plasma of diabetes patients. As a pro-oxidant, 0.10-5 mM aminoacetone can induce cell death in RINm5f pancreatic β-cells. Aminoacetone is used as a growth substrate for Pseudomonas.