(3aR,3bS,6S,6aR,7aR)-6-Hydroxy-2,2-dimethyltetrahydrofuro[2',3':4,5]furo[2,3-d][1,3]dioxol-5(3aH)-one - CAS 20513-98-8

Catalog:	BB016028
Product Name:	(3aR,3bS,6S,6aR,7aR)-6-Hydroxy-2,2-dimethyltetrahydrofuro[2',3':4,5]furo[2,3-d][1,3]dioxol-5(3aH)-one
CAS:	20513-98-8
Synonyms:	α-D-Glucofuranuronic acid, 1,2-O-(1-methylethylidene)-, γ-lactone; Glucofuranuronic acid, 1,2-O-isopropylidene-, γ-lactone, α-D-; 1,2-O-Isopropylidene-α-D-glucurono-6,3-lactone; NSC 382125

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Catalog	Size	Price	Stock	Quantity
BB016028	50 g	$176	In stock
BB016028	100 g	$319	In stock

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IUPAC Name:	(1S,2R,6R,8R,9S)-9-hydroxy-4,4-dimethyl-3,5,7,11-tetraoxatricyclo[6.3.0.02,6]undecan-10-one
Description:	(3aR,3bS,6S,6aR,7aR)-6-Hydroxy-2,2-dimethyltetrahydrofuro[2',3':4,5]furo[2,3-d][1,3]dioxol-5(3aH)-one (CAS# 20513-98-8) is a compound useful in organic synthesis.
Molecular Weight:	216.19
Molecular Formula:	C9H12O6
Canonical SMILES:	CC1(OC2C3C(C(C(=O)O3)O)OC2O1)C
InChI:	InChI=1S/C9H12O6/c1-9(2)14-6-5-4(13-8(6)15-9)3(10)7(11)12-5/h3-6,8,10H,1-2H3/t3-,4+,5-,6+,8+/m0/s1
InChI Key:	BDBGJSXZKMTMGP-UXTLFEIASA-N
Boiling Point:	386.0±42.0°C at 760 mmHg
Density:	1.410±0.06 g/cm3
MDL:	MFCD00061641
LogP:	-0.85090

Publication Number	Title	Priority Date
US-2020299248-A1	Intermediates for the preparation of eribulin thereof	20171121
US-11008296-B2	Intermediates for the preparation of eribulin thereof	20171121
US-2015274656-A1	Glycosidase inhibitors and uses thereof	20120831
US-9809537-B2	Glycosidase inhibitors and uses thereof	20120831
WO-2014032188-A1	Glycosidase inhibitors and uses thereof	20120831

Complexity:	314
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	5
Defined Bond Stereocenter Count:	0
Exact Mass:	216.0633881
Formal Charge:	0
Heavy Atom Count:	15
Hydrogen Bond Acceptor Count:	6
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	216.0633881
Rotatable Bond Count:	0
Topological Polar Surface Area:	74.2
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	-0.5

(3aR,3bS,6S,6aR,7aR)-6-Hydroxy-2,2-dimethyltetrahydrofuro[2',3':4,5]furo[2,3-d][1,3]dioxol-5(3aH)-one - CAS 20513-98-8

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