Methyl 5-(2-bromoacetyl)thiophene-2-carboxylate

HCID 13727591
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Grundinformationen

CAS
4192-32-9
Standard-SMILES
COC(=O)c1ccc(C(=O)CBr)s1
InChIKey
KKPYVZJBLYIYRX-UHFFFAOYSA-N
Summenformel
C8H7BrO3S
Durchschnittliche Molmasse
263,11 g/mol
Monoisotopische Masse
261,92993

Namen und Bezeichner

Bevorzugter Name
Methyl 5-(2-bromoacetyl)thiophene-2-carboxylate
IUPAC
methyl 5-(2-bromoacetyl)thiophene-2-carboxylate
Englischer Name
5-(2-BroMo-acetyl)-thiophene-2-carboxylic acid Methyl ester
Summenformel
C8H7BrO3S
Molmasse
263.11

Namen und Synonyme

Methyl 5-(2-bromoacetyl)thiophene-2-carboxylateRefChem:816657825-766-04192-32-95-(2-Bromo-acetyl)-thiophene-2-carboxylic acid methyl esterMFCD13191387Methyl 5-(bromoacetyl)thiophene-2-carboxylate2-bromo-1-(5-methoxycarbonylthiophen-2-yl)-ethanone5-(2-Bromoacetyl)thiophene-2-carboxylic acid methyl esterSCHEMBL277652DTXSID40547767KKPYVZJBLYIYRX-UHFFFAOYSA-N
Weitere Namen anzeigen
Arotinolol Impurity 262-Thiophenecarboxylic acid, 5-(2-bromoacetyl)-, methyl ester
EAA19232AKOS022172501AS-48198SY191870DB-358545CS-0217630EN300-80316methyl 5-(bromoacetyl)-2-thiophenecarboxylate

Datenbank-Bezeichner

CAS
4192-32-9
PubChem CID
13727591
DTXSID
DTXSID40547767
EC Number
825-766-0

Eigenschaften

Berechnete Struktureigenschaften

XLogP
2,6
Polarare Oberfläche (TPSA)
71,6 Ų
H-Brücken-Donoren
0
H-Brücken-Akzeptoren
4
Frei drehbare Bindungen
4
Schwere Atome
13

Physikochemische Eigenschaften

Schmelzpunkt
122 · 122-123 °C
Siedepunkt
375.6 · 375.6±32.0 °C(Predicted)
Dichte
1.628 · 1.628±0.06 g/cm3(Predicted)
storage temp.
2 · 2-8°C

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Danger

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H318 (100%): Causes serious eye damage [Danger Serious eye damage/eye irritation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+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.；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.

Gefahrenhinweise

Hazard Classes and CategoriesAcute Tox. 4 (100%)；Skin Irrit. 2 (100%)；Eye Dam. 1 (100%)；STOT SE 3 (100%)

Sicherheitsdaten

Alarmwort
Achtung
Gefahrenhinweise
Code Gefahrenhinweise Gefahrenklasse Abteilung Alarmwort Symbol P-Code H315

Chemie und Industrie

Anbieter16 Anbieter

毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
苏州施亚生物科技有限公司17715136450 · [email protected]
苏州施亚生物科技有限公司86(512)5235 8471 17715136450 · [email protected]
深圳康特腾科技有限公司86-0755-86635001 · [email protected]

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