3-Methylcyclopentanol, mixture of isomers - CAS 18729-48-1

Catalog:	BB014414
Product Name:	3-Methylcyclopentanol, mixture of isomers
CAS:	18729-48-1
Synonyms:	3-methylcyclopentan-1-ol

Technical Data

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Computed Properties

IUPAC Name:	3-methylcyclopentan-1-ol
Description:	3-Methylcyclopentanol, mixture of isomers (CAS# 18729-48-1) is a useful research chemical.
Molecular Weight:	100.16
Molecular Formula:	C6H12O
Canonical SMILES:	CC1CCC(C1)O
InChI:	InChI=1S/C6H12O/c1-5-2-3-6(7)4-5/h5-7H,2-4H2,1H3
InChI Key:	VEALHWXMCIRWGC-UHFFFAOYSA-N
Boiling Point:	146.9 °C at 760 mmHg
Purity:	95 %
Density:	0.91 g/mL at 25 °C (lit.)
Appearance:	Colorless liquid
Storage:	Flammables area
MDL:	MFCD00001368
LogP:	1.16730

Publication Number	Title	Priority Date
WO-2021154915-A1	Sensor calibration and operation	20200129
CN-112859516-A	Material for forming organic film, method for forming pattern, and polymer	20191128
EP-3828630-A1	Material for forming organic film, patterning process, and polymer	20191128
JP-2021084974-A	Organic film forming materials, pattern forming methods, and polymers	20191128
KR-20210066740-A	Material for forming organic film, patterning process, and polymer	20191128

PMID	Publication Date	Title	Journal
22649749	20120101	Acylation of Chiral Alcohols: A Simple Procedure for Chiral GC Analysis	Journal of analytical methods in chemistry

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Related Functional Groups

Alcohols and Derivatives

[77987-49-6]
Z-Glycinol
[113724-48-4]
(R)-1-(2-Methoxyphenyl)ethanol
[112256-09-4]
1-Cyclopentyl-2-propyn-1-ol
[2006278-33-5]
2-(6-Methoxy-2-naphthyl)-4-pentyn-2-ol
[5272-36-6]
3-(Trimethylsilyl)propargyl alcohol
[155310-11-5]
3-Amino-2,2-difluoro-1-propanol

Oxygen Compounds

[1035840-45-9]
1-(5-Methoxy-1,3-benzoxazol-2-yl)piperidine-3-carboxylic acid
[1281984-38-0]
1-Cyclopentyl-3,5-dinitro-1H-pyrazole
[202288-73-1]
2-(Pyridin-3-ylmethoxy)aniline dihydrochloride
[2960-93-2]
2,2'-Dimethoxy-1,1'-binaphthalene
[35989-28-7]
2,5-Dichloro-4-fluorobenzoic acid
[5724-76-5]
3-(2,5-Dioxopyrrolidin-1-yl)propionic acid

GHS Hazard Statement:	H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]
Precautionary Statement:	P210, P233, P240, P241, P242, P243, P280, P303+P361+P353, P370+P378, P403+P235, and P501
Signal Word:	Warning

Complexity:	61.2
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	100.088815002
Formal Charge:	0
Heavy Atom Count:	7
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	100.088815002
Rotatable Bond Count:	0
Topological Polar Surface Area:	20.2 Å²
Undefined Atom Stereocenter Count:	2
Undefined Bond Stereocenter Count:	0
XLogP3:	1.2