4-Hydroxynicotinic acid

Odhpca · 4-oxo-1,4-dihydro-3-pyridinecarboxylic acid · 1,4-dihydro-4-oxopyridine-3-carboxylic acid · 4-Oxo-1,4-dihydropyridine-3-carboxylic acid · 3-Pyridinecarboxylic acid, 1,4-dihydro-4-oxo-

https://huagongshe.com/ja/chemical/69113

識別子と物理属性

CAS No.	609-70-1
分子式	C6H5NO3
平均分子量	139.11 g/mol
単同位体質量	139.02694302 g/mol
SMILES	O=C(O)c1c[nH]ccc1=O
InChIKey	CHCUBGPSZDGABM-UHFFFAOYSA-N
PubChem CID	69113
ChEMBL	CHEMBL1610346
EC No.	210-197-7
DTXSID	DTXSID80976370

化学・物理的性質

XLogP	0.4
極性表面積	66.4
水素結合供与体数	2
水素結合受容体数	4
回転可能結合数	1
重原子数	10
形式電荷	0
複雑度	239

安全性と法規制

GHS 分類	WarningH302 (84.4%): 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 45 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard Classes and Categories	Acute Tox. 4 (84.4%)

GHS 分類

WarningH302 (84.4%): 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 45 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard Classes and Categories

Acute Tox. 4 (84.4%)