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3-(propan-2-yl)cyclobutane-1-carboxylic acid

3-(propan-2-yl)cyclobutane-1-carboxylic acid - CAS 13363-91-2

Catalog:	BB007791
Product Name:	3-(propan-2-yl)cyclobutane-1-carboxylic acid
CAS:	13363-91-2
Synonyms:	3-propan-2-yl-1-cyclobutanecarboxylic acid; 3-propan-2-ylcyclobutane-1-carboxylic acid

Technical Data

Patents

Computed Properties

IUPAC Name:	3-propan-2-ylcyclobutane-1-carboxylic acid
Description:	3-(propan-2-yl)cyclobutane-1-carboxylic acid (CAS# 13363-91-2 ) is a useful research chemical.
Molecular Weight:	142.198
Molecular Formula:	C8H14O2
Canonical SMILES:	CC(C)C1CC(C1)C(=O)O
InChI:	InChI=1S/C8H14O2/c1-5(2)6-3-7(4-6)8(9)10/h5-7H,3-4H2,1-2H3,(H,9,10)
InChI Key:	SIDXWUAGUXXTNA-UHFFFAOYSA-N
Boiling Point:	222.4 °C at 760 mmHg
Density:	1.05 g/cm³
LogP:	1.75320

Publication Number	Title	Priority Date
US-10683280-B2	Chemokine receptor modulators and uses thereof	20180126
US-2019233397-A1	Chemokine receptor modulators and uses thereof	20180126
US-2020325117-A1	Chemokine receptor modulators and uses thereof	20180126
US-2020339539-A1	Chemokine receptor modulators and uses thereof	20180126
US-2017197986-A1	Dihydropyrimido loop derivative as hbv inhibitor	20140530

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Related Functional Groups

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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
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.8