Ethyl 3-(chlorosulfonyl)propanoate

HCID 4128467

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Grundinformationen

CAS: 103472-25-9
Standard-SMILES: CCOC(=O)CCS(=O)(=O)Cl
InChIKey: JIQDEHYHHKZBRI-UHFFFAOYSA-N
Summenformel: C5H9ClO4S
Durchschnittliche Molmasse: 200,64 g/mol
Monoisotopische Masse: 199,9910076

Namen und Bezeichner

Bevorzugter Name: Ethyl 3-(chlorosulfonyl)propanoate
IUPAC: ethyl 3-chlorosulfonylpropanoate
Englischer Name: ethyl 3-(chlorosulfonyl)propanoate
Summenformel: C5H9ClO4S
Molmasse: 200.64

Namen und Synonyme

ethyl 3-(chlorosulfonyl)propanoate103472-25-9DTXSID30399636RefChem:343236DTXCID20350493865-608-8Ethyl 3-chlorosulfonylpropanoateethyl 3-(chlorosulfonyl)propionateMFCD07186267SCHEMBL1411856JIQDEHYHHKZBRI-UHFFFAOYSA-N2-Carboethoxyethylsulfonyl chloride

Weitere Namen anzeigen

ethyl 3-sulfopropanoatePropanoic acid, 3-(chlorosulfonyl)-, ethyl ester

DEA47225AC2764SBB092679AKOS005072553GC-0767DA-19580SY034662EN300-51864

Datenbank-Bezeichner

CAS: 103472-25-9
PubChem CID: 4128467
DTXSID: DTXSID30399636
EC Number: 865-608-8

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 0,6
Polarare Oberfläche (TPSA): 68,8 Å²
H-Brücken-Donoren: 0
H-Brücken-Akzeptoren: 4
Frei drehbare Bindungen: 5
Schwere Atome: 11
Formalladung: 0
Komplexität: 215

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Danger

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H312 (100%): Harmful in contact with skin [Warning Acute toxicity, dermal]；H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]；H332 (100%): Harmful if inhaled [Warning Acute toxicity, inhalation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P260, P261, P264, P270, P271, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P319, P321, P330, P362+P364, P363, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 2 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；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.