2-하이드록시-5-설파모일벤조산

2-하이드록시-5-설파모일벤조산 · Sulpiride Impurity 7 · 5-Sulfamoylsalicylic acid · 2-hydroxy-5-sulfaMoylbenzoic acid · 2-hydroxy-5-sulfonamidobenzoic acid · Benzoic acid, 5-(aminosulfonyl)-2-hydroxy-

https://huagongshe.com/ko/chemical/7731270

식별자 및 물리적 특성

CAS No.	5378-41-6
분자식	C7H7NO5S
평균 분자량	217.2 g/mol
SMILES	NS(=O)(=O)c1ccc(O)c(C(=O)O)c1
InChIKey	WKQMYKUTVQZUBG-UHFFFAOYSA-N
PubChem CID	7731270
EC No.	641-620-7
현지명	2-하이드록시-5-설파모일벤조산

화학 및 물리적 성질

XLogP	1.1
극성 표면적	126
수소 결합 공여자 수	3
수소 결합 수용자 수	6
회전 가능 결합 수	2
무거운 원자 수	14
형식 전하	0
복잡도	319
녹는점	256-259℃ (ethanol )
끓는 점	509.1±60.0 °C(Predicted)
밀도	1.679±0.06 g/cm3(Predicted)
pKa(산도 계수)	2.40±0.10(Predicted)

안전 및 규제

GHS 분류	WarningH302 (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)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.
Hazard Classes and Categories	Acute Tox. 4 (100%)

GHS 분류

WarningH302 (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)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.

Hazard Classes and Categories

Acute Tox. 4 (100%)