3-Cyclopentyl-1-propanol - CAS 767-05-5

Catalog:	BB035682
Product Name:	3-Cyclopentyl-1-propanol
CAS:	767-05-5
Synonyms:	3-cyclopentylpropan-1-ol

Technical Data

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Computed Properties

IUPAC Name:	3-cyclopentylpropan-1-ol
Description:	3-Cyclopentyl-1-propanol (CAS# 767-05-5) is a useful research chemical.
Molecular Weight:	128.21
Molecular Formula:	C8H16O
Canonical SMILES:	C1CCC(C1)CCCO
InChI:	InChI=1S/C8H16O/c9-7-3-6-8-4-1-2-5-8/h8-9H,1-7H2
InChI Key:	IBMXMCXCSPGCDQ-UHFFFAOYSA-N
Boiling Point:	93-95 °C / 8 mmHg (lit.)
Density:	0.907 g/mL at 25 °C (lit.)
Appearance:	Clear light yellow liquid
MDL:	MFCD00001393
LogP:	1.94910

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GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P264, P270, P280, P301+P312, P305+P351+P338, P330, P337+P313, and P501
Signal Word:	Warning

Complexity:	65
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	128.120115130
Formal Charge:	0
Heavy Atom Count:	9
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	128.120115130
Rotatable Bond Count:	3
Topological Polar Surface Area:	20.2 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.5