Heptaminol

heptaminol · 2-Heptanol, 6-amino-2-methyl- · Heptaminol API · TIMTEC-BB SBB004116 · 6-amino-2-methyl-2-heptano · 6-AMino-2-Methylheptan-2-ol · 6-Amino-2-methyl-2-heptanol · 2-Methyl-6-aminoheptane-2-ol

https://huagongshe.com/ko/chemical/3590

식별자 및 물리적 특성

CAS No.	372-66-7
분자식	C8H19NO
평균 분자량	145.24 g/mol
단동위원소 질량	145.14666423 g/mol
SMILES	CC(N)CCCC(C)(C)O
InChIKey	LREQLEBVOXIEOM-UHFFFAOYSA-N
PubChem CID	3590
ChEMBL	CHEMBL2111076
ChEBI	CHEBI:94362
EC No.	206-758-0
DTXSID	DTXSID4048484

화학 및 물리적 성질

XLogP	0.7
극성 표면적	46.3
수소 결합 공여자 수	2
수소 결합 수용자 수	2
회전 가능 결합 수	4
무거운 원자 수	10
형식 전하	0
복잡도	91.3
Human Drugs	Pharmaceuticals
Collision Cross Section	132.54 Å² [M+H-H2O]+ [CCS Type: TWMethod: calibrated with polyalanine and drug standards]
녹는점	<25 °C
끓는 점	115 °C (11.2515 mmHg)
밀도	0.895
굴절률	1.455-1.457
저장 조건	Refrigerator
용해도	DMSO(약간 용해됨), 메탄올(약간 용해됨)
pKa(산도 계수)	15.30±0.29(Predicted)
물리적 상태	기름진 액체
색상	무색의

화학적 성질

CLEAR COLOURLESS OILY LIQUID

안전 및 규제

GHS 분류	DangerH314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]P260, P261, P264, P264+P265, P271, P280, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P351+P338, P305+P354+P338, P316, P319, P321, P332+P317, P337+P317, P362+P364, P363, 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.
Hazard Classes and Categories	Skin Corr. 1B (100%)
Drug Induced Liver Injury	Drug-Induced Liver Injury Severity and Toxicity (DILIst)HeptaminolDILI PositiveDOI:10.1016/j.drudis.2019.09.022
관세 코드	29221985
위험 문구(R)	34
위험 표시	C
안전 문구(S)	45-36/37/39-26
기존화학 물질	KE-01460

용도

개요

Heptaminol is an aliphatic amine with cardiotonic and sympathomimetic activities. It decreases the amplitude of peak calcium currents by 30% in isolated guinea pig ventricular myocytes when used at a concentration of 100 μM. Heptaminol inhibits norepinephrine uptake and induces catecholamine release in primary bovine chromaffin cells. It increases blood pressure in cats when administered intravenously at a dose of 15 mg, an effect that can be blocked by reserpine .

용도

vasodilator