3-(Hydroxymethyl)tetrahydrofuran - CAS 15833-61-1

Catalog:	BB011404
Product Name:	3-(Hydroxymethyl)tetrahydrofuran
CAS:	15833-61-1
Synonyms:	3-oxolanylmethanol; oxolan-3-ylmethanol

Technical Data

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Computed Properties

IUPAC Name:	oxolan-3-ylmethanol
Description:	3-(Hydroxymethyl)tetrahydrofuran (CAS# 15833-61-1) is a useful research chemical.
Molecular Weight:	102.13
Molecular Formula:	C5H10O2
Canonical SMILES:	C1COCC1CO
InChI:	InChI=1S/C5H10O2/c6-3-5-1-2-7-4-5/h5-6H,1-4H2
InChI Key:	PCPUMGYALMOCHF-UHFFFAOYSA-N
Boiling Point:	76-77 °C
Density:	1.456 g/cm³
MDL:	MFCD00075198
LogP:	0.01520

Publication Number	Title	Priority Date
US-2016168090-A1	Novel indole derivatives and their use in neurodegenerative diseases	20141215
WO-2015198045-A1	3-substituted 2-amino-indole derivatives	20140625
WO-2015198046-A1	1,3-substituted 2-aminoindole derivatives and analogues useful in the treatment or prevention of diabetes mellitus, obesity and inflammatory bowel disease	20140625
WO-2015181186-A1	1 -(cyclopent-2-en-1 -yl)-3-(2-hydroxy-3-(arylsulfonyl)phenyl)urea derivatives as cxcr2 inhibitors	20140529
US-2015225358-A1	Process for making certain epoxidized fatty acid ester plasticizers	20140212

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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, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	54
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	102.068079557
Formal Charge:	0
Heavy Atom Count:	7
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	102.068079557
Rotatable Bond Count:	1
Topological Polar Surface Area:	29.5 Å²
Undefined Atom Stereocenter Count:	1
Undefined Bond Stereocenter Count:	0
XLogP3:	-0.2