2-(1-Methylcyclopentyl)acetic Acid - CAS 933-47-1

Catalog:	BB040854
Product Name:	2-(1-Methylcyclopentyl)acetic Acid
CAS:	933-47-1
Synonyms:	2-(1-methylcyclopentyl)acetic acid; 2-(1-methylcyclopentyl)acetic acid

Technical Data

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Computed Properties

IUPAC Name:	2-(1-methylcyclopentyl)acetic acid
Description:	2-(1-Methylcyclopentyl)acetic Acid (CAS# 933-47-1) is a useful research chemical.
Molecular Weight:	142.20
Molecular Formula:	C8H14O2
Canonical SMILES:	CC1(CCCC1)CC(=O)O
InChI:	InChI=1S/C8H14O2/c1-8(6-7(9)10)4-2-3-5-8/h2-6H2,1H3,(H,9,10)
InChI Key:	ZHQAIBYWBFMHHQ-UHFFFAOYSA-N
LogP:	2.04140

Publication Number	Title	Priority Date
EP-3644990-A1	5-(pyridin-3-yl)oxazole allosteric modulators of the m4 muscarinic acetylcholine receptor	20170627
US-2020109137-A1	5-(pyridin-3-yl)oxazole allosteric modulators of the m4 muscarinic acetylcholine receptor	20170627
WO-2019000238-A1	5- (PYRIDIN-3-YL) OXAZOLE ALLOSTERIC MODULATORS OF M4 ACETYLCHOLINE MUSCARINIC RECEPTOR	20170627
WO-2019005589-A1	5- (PYRIDIN-3-YL) OXAZOLE TYPE ALLOSTERIC MODULATORS OF ACETYLCHOLINE M4 MUSCARINIC RECEPTOR	20170627
US-10981902-B2	5-(pyridin-3-yl)oxazole allosteric modulators of the M4 muscarinic acetylcholine receptor	20170627

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Related Functional Groups

Carbonyl Compounds

[1383427-98-2]
(S)-Hexahydropyrazino[2,1-c][1,4]oxazin-4(3H)-one hydrochloride
[17746-05-3]
Undecanoyl chloride
[959574-98-2]
(3-Phenyl-1H-pyrazol-1-yl)acetic acid
[70199-62-1]
(4-Pyridyl)acetone Hydrochloride
[35153-16-3]
(Z)-10-Tetradecenyl Acetate
[1035840-45-9]
1-(5-Methoxy-1,3-benzoxazol-2-yl)piperidine-3-carboxylic acid

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GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
Precautionary Statement:	P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P332+P313, P362, P403+P233, P405, and P501
Signal Word:	Danger

Complexity:	134
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	142.099379685
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	142.099379685
Rotatable Bond Count:	2
Topological Polar Surface Area:	37.3 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.3