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HCID 75525Erstellt: 27. Oktober 2026

Phthalimide, N-(2-formylethyl)-

3-(1,3-Dioxoisoindolin-2-yl)propanal · 3-Phthalimidopropionaldehyde · 3-Phthalimidylpropanal · N-(3-Oxopropyl)phthalimide · Phthalimidopropionaldehyde · 3-(Phthalimid-1-yl)propanal · N-(2-Formylethyl)phthalimide · Phthalimide, N-(2-formylethyl)-

https://huagongshe.com/de/chemical/75525

Molekülstruktur von Phthalimide, N-(2-formylethyl)-

Identifikatoren & physikalische Daten

CAS No.	2436-29-5
Summenformel	C11H9NO3
Durchschnittliche Molmasse	203,19 g/mol
Monoisotopische Masse	203,05824315 g/mol
SMILES	O=CCCN1C(=O)c2ccccc2C1=O
InChIKey	IBSDSIHTMABATG-UHFFFAOYSA-N
PubChem CID	75525
EC No.	700-133-0
DTXSID	DTXSID90179097

Chemische & physikalische Eigenschaften

XLogP	0,9
Polarare Oberfläche (TPSA)	54,5
H-Brücken-Donoren	0
H-Brücken-Akzeptoren	3
Frei drehbare Bindungen	3
Schwere Atome	15
Formalladung	0
Komplexität	276
Schmelzpunkt	136-141 ºC
Siedepunkt	352.7±25.0 °C(Predicted)
Dichte	1.319±0.06 g/cm3(Predicted)
Lagerbedingungen	Inert atmosphere,Store in freezer, under -20°C
Aggregatzustand	solid
pKa (Säurekonstante)	-2.24±0.20(Predicted)
Farbe	White
InChI	InChI=1S/C11H9NO3/c13-7-3-6-12-10(14)8-4-1-2-5-9(8)11(12)15/h1-2,4-5,7H,3,6H2
InChIKey	IBSDSIHTMABATG-UHFFFAOYSA-N
SMILES	C1(=O)C2=C(C=CC=C2)C(=O)N1CCC=O
CAS Datenbank	2436-29-5(CAS DataBase Reference)

Sicherheit & Vorschriften

GHS-Einstufung	This chemical does not meet GHS hazard criteria for 44.4% (4 of 9) of reports.WarningH302 (33.3%): Harmful if swallowed [Warning Acute toxicity, oral]H312 (33.3%): Harmful in contact with skin [Warning Acute toxicity, dermal]H315 (55.6%): Causes skin irritation [Warning Skin corrosion/irritation]H319 (55.6%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]H332 (33.3%): Harmful if inhaled [Warning Acute toxicity, inhalation]H335 (44.4%): 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, 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 9 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.Reported as not meeting GHS hazard criteria per 4 of 9 reports by companies.There are 4 notifications provided by 5 of 9 reports by companies with hazard statement code(s).Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.
Regulatorische Informationen	Status: Active Update: 21-10-2011 https://echa.europa.eu/registration-dossier/-/registered-dossier/4867Status: Active Update: 05-12-2008 https://echa.europa.eu/registration-dossier/-/registered-dossier/18300
Hazard Classes and Categories	Acute Tox. 4 (33.3%)Skin Irrit. 2 (55.6%)Eye Irrit. 2 (55.6%)STOT SE 3 (44.4%)
Zollcode	2909498090
R-Sätze (R)	22-36-43
Toxizität	mouse,LD50,intraperitoneal,1055mg/kg (1055mg/kg),BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY),Journal of Pharmaceutical Sciences. Vol. 57, Pg. 815, 1968.

CAS No.

2436-29-5

Summenformel

C11H9NO3

Durchschnittliche Molmasse

203,19 g/mol

Monoisotopische Masse

203,05824315 g/mol

SMILES

O=CCCN1C(=O)c2ccccc2C1=O

InChIKey

IBSDSIHTMABATG-UHFFFAOYSA-N

PubChem CID

75525

EC No.

700-133-0

DTXSID

DTXSID90179097

Chemische & physikalische Eigenschaften

XLogP

0,9

Polarare Oberfläche (TPSA)

54,5

H-Brücken-Donoren

H-Brücken-Akzeptoren

Frei drehbare Bindungen

Schwere Atome

Formalladung

Komplexität

276

Schmelzpunkt

136-141 ºC

Siedepunkt

352.7±25.0 °C(Predicted)

Dichte

1.319±0.06 g/cm3(Predicted)

Lagerbedingungen

Inert atmosphere,Store in freezer, under -20°C

Aggregatzustand

solid

pKa (Säurekonstante)

-2.24±0.20(Predicted)

Farbe

White

InChI

InChI=1S/C11H9NO3/c13-7-3-6-12-10(14)8-4-1-2-5-9(8)11(12)15/h1-2,4-5,7H,3,6H2

InChIKey

IBSDSIHTMABATG-UHFFFAOYSA-N

SMILES

C1(=O)C2=C(C=CC=C2)C(=O)N1CCC=O

CAS Datenbank

2436-29-5(CAS DataBase Reference)

Sicherheit & Vorschriften

GHS-Einstufung

This chemical does not meet GHS hazard criteria for 44.4% (4 of 9) of reports.WarningH302 (33.3%): Harmful if swallowed [Warning Acute toxicity, oral]H312 (33.3%): Harmful in contact with skin [Warning Acute toxicity, dermal]H315 (55.6%): Causes skin irritation [Warning Skin corrosion/irritation]H319 (55.6%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]H332 (33.3%): Harmful if inhaled [Warning Acute toxicity, inhalation]H335 (44.4%): 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, 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 9 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.Reported as not meeting GHS hazard criteria per 4 of 9 reports by companies.There are 4 notifications provided by 5 of 9 reports by companies with hazard statement code(s).Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

Regulatorische Informationen

Status: Active Update: 21-10-2011 https://echa.europa.eu/registration-dossier/-/registered-dossier/4867Status: Active Update: 05-12-2008 https://echa.europa.eu/registration-dossier/-/registered-dossier/18300

Hazard Classes and Categories

Acute Tox. 4 (33.3%)Skin Irrit. 2 (55.6%)Eye Irrit. 2 (55.6%)STOT SE 3 (44.4%)

Zollcode

2909498090

R-Sätze (R)

22-36-43

Toxizität

mouse,LD50,intraperitoneal,1055mg/kg (1055mg/kg),BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY),Journal of Pharmaceutical Sciences. Vol. 57, Pg. 815, 1968.