(S)-4-(2-Hydroxyethyl)-2,2-dimethyl-1,3-dioxolane - CAS 32233-43-5

Name: (S)-4-(2-Hydroxyethyl)-2,2-dimethyl-1,3-dioxolane
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB021235
Product Name:	(S)-4-(2-Hydroxyethyl)-2,2-dimethyl-1,3-dioxolane
CAS:	32233-43-5
Synonyms:	2-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]ethanol; 2-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]ethanol

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Computed Properties

IUPAC Name:	2-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]ethanol
Description:	(S)-4-(2-Hydroxyethyl)-2,2-dimethyl-1,3-dioxolane (CAS# 32233-43-5) is a useful research chemical.
Molecular Weight:	146.18
Molecular Formula:	C7H14O3
Canonical SMILES:	CC1(OCC(O1)CCO)C
InChI:	InChI=1S/C7H14O3/c1-7(2)9-5-6(10-7)3-4-8/h6,8H,3-5H2,1-2H3/t6-/m0/s1
InChI Key:	YYEZYENJAMOWHW-LURJTMIESA-N
Boiling Point:	201.2 °C at 760 mmHg
Density:	1.013 g/cm³
Appearance:	Colorless liquid
MDL:	MFCD02682967
LogP:	5.89730

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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

Publication Number	Title	Priority Date
WO-2021018858-A1	6,7-dihydro-5h-pyrido[2,3-c]pyridazine derivatives and related compounds as bcl-xl protein inhibitors and pro-apoptotic agents for treating cancer	20190729
AU-2019313082-A1	Benzene derivative	20180731
CN-112513011-A	Benzene derivatives	20180731
KR-20210038558-A	Benzene derivatives	20180731
EP-3831810-A1	Benzene derivative	20180731

Complexity:	111
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	1
Defined Bond Stereocenter Count:	0
Exact Mass:	146.094294304
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	146.094294304
Rotatable Bond Count:	2
Topological Polar Surface Area:	38.7 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.2