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Ethyl 1,4,5,6-Tetrahydropyrrolo[3,4-c]pyrazole-3-carboxylate

Ethyl 1,4,5,6-Tetrahydropyrrolo[3,4-c]pyrazole-3-carboxylate - CAS 912635-62-2

Catalog:	BB040098
Product Name:	Ethyl 1,4,5,6-Tetrahydropyrrolo[3,4-c]pyrazole-3-carboxylate
CAS:	912635-62-2
Synonyms:	1,4,5,6-tetrahydropyrrolo[3,4-c]pyrazole-3-carboxylic acid ethyl ester; ethyl 1,4,5,6-tetrahydropyrrolo[3,4-c]pyrazole-3-carboxylate

Technical Data

Patents

Computed Properties

IUPAC Name:	ethyl 1,4,5,6-tetrahydropyrrolo[3,4-c]pyrazole-3-carboxylate
Description:	Ethyl 1,4,5,6-Tetrahydropyrrolo[3,4-c]pyrazole-3-carboxylate (CAS# 912635-62-2 ) is a useful research chemical.
Molecular Weight:	181.19
Molecular Formula:	C8H11N3O2
Canonical SMILES:	CCOC(=O)C1=NNC2=C1CNC2
InChI:	InChI=1S/C8H11N3O2/c1-2-13-8(12)7-5-3-9-4-6(5)10-11-7/h9H,2-4H2,1H3,(H,10,11)
InChI Key:	OWUQEUFWBVGZJW-UHFFFAOYSA-N
LogP:	0.51840

Publication Number	Title	Priority Date
CA-2602303-A1	Tricyclic azole derivatives, their manufacture and use as pharmaceutical agents	20050414
EP-1885725-A1	Tricyclic azole derivatives, their manufacture and use as pharmaceutical agents	20050414
EP-1885725-B1	Tricyclic azole derivatives, their manufacture and use as pharmaceutical agents	20050414
ES-2314879-T3	TRICYCLE AZOL DERIVATIVES, THEIR DEVELOPMENT AND USE AS PHARMACEUTICAL AGENTS.	20050414
JP-2008533181-A	Tricyclic azole derivatives, their production and use as pharmaceuticals	20050414

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Related Functional Groups

Carbonyl Compounds

[91125-43-8]
Sulfophenyl nonanoate sodium salt
[959574-98-2]
(3-Phenyl-1H-pyrazol-1-yl)acetic acid
[35153-16-3]
(Z)-10-Tetradecenyl Acetate
[956439-56-8]
1-(Carboxymethyl)-3-nitro-1H-pyrazole-5-carboxylic acid
[1016519-61-1]
2-(Methyl-2-pyridylamino)acetic Acid
[108397-75-7]
2,4,6-Trimethylpyrimidine-5-carboxylic Acid

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Complexity:	210
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	181.085126602
Formal Charge:	0
Heavy Atom Count:	13
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	181.085126602
Rotatable Bond Count:	3
Topological Polar Surface Area:	67
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	-0.3