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6,7-Dihydro-1H-cyclopenta[b]pyridin-2(5H)-one

6,7-Dihydro-1H-cyclopenta[b]pyridin-2(5H)-one - CAS 88499-85-8

Catalog:	BB038893
Product Name:	6,7-Dihydro-1H-cyclopenta[b]pyridin-2(5H)-one
CAS:	88499-85-8
Synonyms:	1,5,6,7-tetrahydrocyclopenta[b]pyridin-2-one; 1,5,6,7-tetrahydrocyclopenta[b]pyridin-2-one

Technical Data

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Patents

Computed Properties

IUPAC Name:	1,5,6,7-tetrahydrocyclopenta[b]pyridin-2-one
Description:	6,7-Dihydro-1H-cyclopenta[b]pyridin-2(5H)-one (CAS# 88499-85-8 ) is a useful research chemical.
Molecular Weight:	135.16
Molecular Formula:	C8H9NO
Canonical SMILES:	C1CC2=C(C1)NC(=O)C=C2
InChI:	InChI=1S/C8H9NO/c10-8-5-4-6-2-1-3-7(6)9-8/h4-5H,1-3H2,(H,9,10)
InChI Key:	GXXRRIYKTZNCNC-UHFFFAOYSA-N
Boiling Point:	402.7 °C at 760 mmHg
Density:	1.17 g/cm³
Appearance:	Solid
LogP:	1.27590

Publication Number	Title	Priority Date
CN-112375101-A	Method for preparing chiral nitrogen-phosphorus ligand L-8 containing pyridocyclohexane	20201206
CN-109320499-A	Pyrrole-3-carboxamide class compound and its preparation method and application	20181114
WO-2020102096-A1	Compounds and compositions for treating conditions associated with nlrp activity	20181113
TW-202031647-A	Compounds and compositions for treating conditions associated with nlrp activity	20181113
EP-3880660-A1	Compounds and compositions for treating conditions associated with nlrp activity	20181113

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Related Functional Groups

Carbonyl Compounds

[91125-43-8]
Sulfophenyl nonanoate sodium salt
[1427004-19-0]
DBCO-PEG4-NHS ester
[956439-56-8]
1-(Carboxymethyl)-3-nitro-1H-pyrazole-5-carboxylic acid
[70912-52-6]
1,3-Dioxane-4,6-dione,2,2-dimethyl-5-(2-pyrrolidinylidene)-
[1431966-64-1]
1-{2-[(3-Methoxypropyl)amino]-4-methyl-1,3-thiazol-5-yl}ethanone hydrochloride
[1018125-51-3]
2-(6-Ethyl-3-methyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-1-yl)acetic acid

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GHS Hazard Statement:	H303 (100%): May be harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	238
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	135.068413911
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	135.068413911
Rotatable Bond Count:	0
Topological Polar Surface Area:	29.1 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.4