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Ethyl 4,5,6,7-Tetrahydro-1H-indazole-3-carboxylate

Ethyl 4,5,6,7-Tetrahydro-1H-indazole-3-carboxylate - CAS 4492-02-8

Catalog:	BB025731
Product Name:	Ethyl 4,5,6,7-Tetrahydro-1H-indazole-3-carboxylate
CAS:	4492-02-8
Synonyms:	4,5,6,7-tetrahydro-1H-indazole-3-carboxylic acid ethyl ester; ethyl 4,5,6,7-tetrahydro-1H-indazole-3-carboxylate

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	ethyl 4,5,6,7-tetrahydro-1H-indazole-3-carboxylate
Description:	Ethyl 4,5,6,7-Tetrahydro-1H-indazole-3-carboxylate (CAS# 4492-02-8) is a useful research chemical.
Molecular Weight:	194.23
Molecular Formula:	C10H14N2O2
Canonical SMILES:	CCOC(=O)C1=NNC2=C1CCCC2
InChI:	InChI=1S/C10H14N2O2/c1-2-14-10(13)9-7-5-3-4-6-8(7)11-12-9/h2-6H2,1H3,(H,11,12)
InChI Key:	HESKTUHERVMQMI-UHFFFAOYSA-N
MDL:	MFCD02942367
LogP:	1.46520

Publication Number	Title	Priority Date
WO-2020112581-A1	Novel substituted piperazine amide compounds as indoleamine 2, 3-dioxygenase (ido) inhibitors	20181128
EP-3886845-A1	Novel substituted piperazine amide compounds as indoleamine 2, 3-dioxygenase (ido) inhibitors	20181128
WO-2020081381-A1	Novel arylalkyl pyrazole compounds as indoleamine 2,3-dioxygenase inhibitors	20181017
EP-3867232-A1	Novel arylalkyl pyrazole compounds as indoleamine 2,3-dioxygenase inhibitors	20181017
WO-2020041100-A1	Novel aryloxypiperidine pyrazole compounds as indoleamine 2,3-dioxygenase inhibitors	20180822

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Related Functional Groups

Carbonyl Compounds

[1035840-45-9]
1-(5-Methoxy-1,3-benzoxazol-2-yl)piperidine-3-carboxylic acid
[832741-29-4]
1-(4-Bromo-5-propylthiophen-2-yl)ethanone
[70912-52-6]
1,3-Dioxane-4,6-dione,2,2-dimethyl-5-(2-pyrrolidinylidene)-
[1018125-51-3]
2-(6-Ethyl-3-methyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-1-yl)acetic acid
[59855-96-8]
2-(Methoxymethyl)thiazole-5-carboxylic Acid
[1016519-61-1]
2-(Methyl-2-pyridylamino)acetic Acid

GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P312, P322, P330, P363, and P501
Signal Word:	Warning

Complexity:	220
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	194.105527694
Formal Charge:	0
Heavy Atom Count:	14
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	194.105527694
Rotatable Bond Count:	3
Topological Polar Surface Area:	55 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2