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Ethyl 1H-pyrrolo[3,2-b]pyridine-2-carboxylate

Ethyl 1H-pyrrolo[3,2-b]pyridine-2-carboxylate - CAS 17288-32-3

Name: Ethyl 1H-pyrrolo[3,2-b]pyridine-2-carboxylate
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB012862
Product Name:	Ethyl 1H-pyrrolo[3,2-b]pyridine-2-carboxylate
CAS:	17288-32-3
Synonyms:	1H-pyrrolo[3,2-b]pyridine-2-carboxylic acid ethyl ester; ethyl 1H-pyrrolo[3,2-b]pyridine-2-carboxylate

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	ethyl 1H-pyrrolo[3,2-b]pyridine-2-carboxylate
Description:	Ethyl 1H-pyrrolo[3,2-b]pyridine-2-carboxylate (CAS# 17288-32-3) is a useful research chemical.
Molecular Weight:	190.20
Molecular Formula:	C10H10N2O2
Canonical SMILES:	CCOC(=O)C1=CC2=C(N1)C=CC=N2
InChI:	InChI=1S/C10H10N2O2/c1-2-14-10(13)9-6-8-7(12-9)4-3-5-11-8/h3-6,12H,2H2,1H3
InChI Key:	NOWHXIDXMNNYBL-UHFFFAOYSA-N
LogP:	1.73960

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Related Functional Groups

Carbonyl Compounds

[91125-43-8]C15H22O5S.Na
Sulfophenyl nonanoate sodium salt
[1383427-98-2]C7H13ClN2O2
(S)-Hexahydropyrazino[2,1-c][1,4]oxazin-4(3H)-one hydrochloride
[70912-52-6]C10H13NO4
1,3-Dioxane-4,6-dione,2,2-dimethyl-5-(2-pyrrolidinylidene)-
[1431966-64-1]C10H17ClN2O2S
1-{2-[(3-Methoxypropyl)amino]-4-methyl-1,3-thiazol-5-yl}ethanone hydrochloride
[253429-30-0]C12H16BrFO3
1-Bromo-2-(2,2-diethoxyethoxy)-4-fluorobenzene
[865774-78-3]C16H21F2NO2
2-(6,8-difluoro-1,2,3,4-tetrahydro-naphthalen-2-ylamino)-pentanoic acid methyl ester

GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	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
Signal Word:	Warning

Publication Number	Title	Priority Date
WO-2021050992-A1	Usp30 inhibitors and uses thereof	20190911
US-2020331911-A1	Kras g12c inhibitors	20190110
EP-3557998-A1	Compouns, compositions and methods of use	20161223
JP-2020503314-A	Compounds, compositions, and methods of use	20161223
WO-2018119395-A1	Compouns, compositions and methods of use	20161223

Complexity:	220
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	190.074227566
Formal Charge:	0
Heavy Atom Count:	14
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	190.074227566
Rotatable Bond Count:	3
Topological Polar Surface Area:	55 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.6