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ethyl 4-bromo-3,5-dimethyl-1H-pyrrole-2-carboxylate

ethyl 4-bromo-3,5-dimethyl-1H-pyrrole-2-carboxylate structure

CAS No:
5408-07-1
Formula:
C9H12BrNO2
Chemical Name:
ethyl 4-bromo-3,5-dimethyl-1H-pyrrole-2-carboxylate
Synonyms:
ethyl 4-bromo-3,5-dimethyl-1H-pyrrole-2-carboxylate;5408-07-1;1H-Pyrrole-2-carboxylic acid, 4-bromo-3,5-dimethyl-, ethyl ester;MFCD02647051;4-bromo-3,5-dimethyl-1H-pyrrole-2-carboxylic acid ethyl ester;ethyl 4-bromo-3,5-dimethylpyrrole-2-carboxylate;NSC10761;SCHEMBL2026881;DTXSID20202408;ZINC158979;CS-B1574;NSC 10761;NSC-10761;SBB053895;AKOS015899109;MCULE-2342988832;NE40147;SY143684;TS-03392;DB-010894;FT-0738230;ST50949734;Y9398;SR-01000530519;J-520975;SR-01000530519-1;W-204292;Z1526503472;Pyrrole-2-carboxylic acid, 4-bromo-3,5-dimethyl-, ethyl ester;1H-Pyrrole-2-carboxylic acid, 4-bromo-3,5-dimethyl,ethyl ester;Ethyl 4-bromo-3,5-dimethyl-1H-pyrrole-2-carboxylate, AldrichCPR

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ethyl 4-bromo-3,5-dimethyl-1H-pyrrole-2-carboxylate Basic Attributes

Molecular Weight：

246.10 g/mol

Exact Mass：

245.00514 g/mol

NSC Number：

10761

DSSTox ID：

DTXSID20202408

Characteristics

PSA：

42.1 Å²

Safety Information

GHS Classification：

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:246.10
XLogP3:2.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:245.00514
Monoisotopic Mass:245.00514
Topological Polar Surface Area:42.1
Heavy Atom Count:13
Complexity:198
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of ethyl 4-bromo-3,5-dimethyl-1H-pyrrole-2-carboxylate

Basic Attributes
Characteristics
Safety Information
Computed Properties
Learn More Other Chemicals

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