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HCID 74624Erstellt: 27. Oktober 2026

N-Methylsalicylamide

NSC 522443 · WLN: QR BVM1 · salicylmethylamide · N-Methylsalicylamide · n-methyl-salicylamid · Salicylamide, N-methyl- · N-Methyl-2-hydroxybenzamide · 2-HYDROXY-N-METHYL-BENZAMIDE

https://huagongshe.com/de/chemical/74624

Molekülstruktur von N-Methylsalicylamide

Identifikatoren & physikalische Daten

CAS No.	1862-88-0
Summenformel	C8H9NO2
Durchschnittliche Molmasse	151,16 g/mol
Monoisotopische Masse	151,06332853 g/mol
SMILES	CNC(=O)c1ccccc1O
InChIKey	BCKXMQIYWWTZDP-UHFFFAOYSA-N
PubChem CID	74624
ChEMBL	CHEMBL5590697
EC No.	833-635-4
DTXSID	DTXSID80171868

Chemische & physikalische Eigenschaften

XLogP	1,3
Polarare Oberfläche (TPSA)	49,3
H-Brücken-Donoren	2
H-Brücken-Akzeptoren	2
Frei drehbare Bindungen	1
Schwere Atome	11
Formalladung	0
Komplexität	147
Schmelzpunkt	89 °C
Siedepunkt	335.8±25.0 °C(Predicted)
Dichte	1.179±0.06 g/cm3(Predicted)
Lagerbedingungen	Sealed in dry,Room Temperature
pKa (Säurekonstante)	8.48±0.35(Predicted)

Sicherheit & Vorschriften

GHS-Einstufung	WarningH302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposureRespiratory tract irritation]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.
Hazard Classes and Categories	Acute Tox. 4 (100%)Skin Irrit. 2 (100%)Eye Irrit. 2A (100%)STOT SE 3 (100%)
Zollcode	2924297099
R-Sätze (R)	41
Toxizität	rat,LD50,intraperitoneal,350mg/kg (350mg/kg),Journal of Pharmacology and Experimental Therapeutics. Vol. 108, Pg. 450, 1953.
Sicherheitshinweise (S)	26-39

CAS No.

1862-88-0

Summenformel

C8H9NO2

Durchschnittliche Molmasse

151,16 g/mol

Monoisotopische Masse

151,06332853 g/mol

SMILES

CNC(=O)c1ccccc1O

InChIKey

BCKXMQIYWWTZDP-UHFFFAOYSA-N

PubChem CID

74624

ChEMBL

CHEMBL5590697

EC No.

833-635-4

DTXSID

DTXSID80171868

Chemische & physikalische Eigenschaften

XLogP

1,3

Polarare Oberfläche (TPSA)

49,3

H-Brücken-Donoren

H-Brücken-Akzeptoren

Frei drehbare Bindungen

Schwere Atome

Formalladung

Komplexität

147

Schmelzpunkt

89 °C

Siedepunkt

335.8±25.0 °C(Predicted)

Dichte

1.179±0.06 g/cm3(Predicted)

Lagerbedingungen

Sealed in dry,Room Temperature

pKa (Säurekonstante)

8.48±0.35(Predicted)

Sicherheit & Vorschriften

GHS-Einstufung

WarningH302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposureRespiratory tract irritation]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.

Hazard Classes and Categories

Acute Tox. 4 (100%)Skin Irrit. 2 (100%)Eye Irrit. 2A (100%)STOT SE 3 (100%)

Zollcode

2924297099

R-Sätze (R)

Toxizität

rat,LD50,intraperitoneal,350mg/kg (350mg/kg),Journal of Pharmacology and Experimental Therapeutics. Vol. 108, Pg. 450, 1953.

Sicherheitshinweise (S)

26-39