3-吡唑甲酸乙酯

Description

Ethyl pyrazole-3-carboxylate · CAS 5932-27-4 · C16H23ClN2O. UNII HMS2828H08.

Identification

CAS Registry Number	5932-27-4
PubChem CID	773315
Molecular formula	C16H23ClN2O
IUPAC name	1-[4-[(2-chlorophenyl)methyl]piperazin-1-yl]-3-methylbutan-1-one
UNII (FDA)	HMS2828H08

Computed Descriptors

Molecular Weight	294.82
XLogP3	2.9
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	4
Exact Mass	294.1498911
Monoisotopic Mass	294.1498911
Topological Polar Surface Area	23.6
Heavy Atom Count	20
Formal Charge	0

Physical description & handling notes

• 30.7 [ug/mL] (The mean of the results at pH 7.4)

Synonyms

1-[4-(2-Chloro-benzyl)-piperazin-1-yl]-3-methyl-butan-1-one; Cambridge id 5932274; Oprea1_214728; Oprea1_495194; MLS001211997; CHEMBL1502508; DTXSID30974745; HMS2828H08; AKOS000553404; LS-14520; SMR000516383; ST50007826; AB00101234-01; 1-(2-chlorobenzyl)-4-(3-methylbutanoyl)piperazine; 1-{4-[(2-chlorophenyl)methyl]piperazinyl}-3-methylbutan-1-one; 1-{4-[(2-chlorophenyl)methyl]piperazin-1-yl}-3-methylbutan-1-one

Frequently Asked Questions

What are the CAS number and molecular formula of Ethyl pyrazole-3-carboxylate?

CAS 5932-27-4; molecular formula C16H23ClN2O; molecular weight — g/mol.

What other names is Ethyl pyrazole-3-carboxylate known by?

1-[4-(2-Chloro-benzyl)-piperazin-1-yl]-3-methyl-butan-1-one, Cambridge id 5932274, Oprea1_214728, Oprea1_495194, MLS001211997, CHEMBL1502508.

Facts on this page are taken from PubChem (US National Library of Medicine) and Wikidata. Grade-specific data — assay, moisture, particle size, packaging, shelf life — is issued per batch on the COA and is not published here.