4-Penten-2-ol - CAS 625-31-0

Catalog:	BB031640
Product Name:	4-Penten-2-ol
CAS:	625-31-0
Synonyms:	pent-4-en-2-ol

Technical Data

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Computed Properties

IUPAC Name:	pent-4-en-2-ol
Description:	4-Penten-2-ol (CAS# 625-31-0 ) is a useful research chemical.
Molecular Weight:	86.13
Molecular Formula:	C5H10O
Canonical SMILES:	CC(CC=C)O
InChI:	InChI=1S/C5H10O/c1-3-4-5(2)6/h3,5-6H,1,4H2,2H3
InChI Key:	ZHZCYWWNFQUZOR-UHFFFAOYSA-N
Boiling Point:	115-116 °C
Purity:	95 %
Density:	0.837 g/cm³
Appearance:	Clear, colorless liquid. flash point: 25 deg c.
Storage:	Flammables area
LogP:	0.94330

Publication Number	Title	Priority Date
CN-112980032-A	Transparent, robust self-cleaning organic glass and manufacturing method thereof	20210423
CN-111658583-A	Preparation method of peony moistening anti-inflammatory essence and essence	20200615
CN-111616999-A	Preparation method of peony soothing and anti-allergy essence and essence	20200615
WO-2021195626-A1	The use of molecularly imprinted polymers for the rapid detection of emerging viral outbreaks	20200327
US-2021284778-A1	Photochromic polydiorganosiloxane vinylic crosslinkers	20200311

PMID	Publication Date	Title	Journal
22163058	20111201	Tissue tropism and target cells of NSs-deleted rift valley fever virus in live immunodeficient mice	PLoS neglected tropical diseases
22017090	20110901	Semi-field evaluation of several novel alkenol analogs of 1-octen-3-ol as attractants to adult Aedes albopictus and Culex quinquefasciatus	Journal of the American Mosquito Control Association
20219777	20100601	Removing the mustard oil bomb from seeds: transgenic ablation of myrosin cells in oilseed rape (Brassica napus) produces MINELESS seeds	Journal of experimental botany
18231835	20080201	Performance of generalist and specialist herbivores and their endoparasitoids differs on cultivated and wild Brassica populations	Journal of chemical ecology
16595939	20060401	Solubility prediction of paracetamol in binary and ternary solvent mixtures using Jouyban-Acree model	Chemical & pharmaceutical bulletin

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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:	41.2
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	86.073164938
Formal Charge:	0
Heavy Atom Count:	6
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	86.073164938
Rotatable Bond Count:	2
Topological Polar Surface Area:	20.2 Å²
Undefined Atom Stereocenter Count:	1
Undefined Bond Stereocenter Count:	0
XLogP3:	1.1