D-glycero-D-gulo-heptono-1,4-lactone

Catalog	BBC89678
CAS	89-67-8
Structure
Synonyms	3α,4α-Dihydroxy-5α-[(1R,2R)-1,2,3-trihydroxypropyl]-4,5-dihydrofuran-2(3H)-one
IUPAC Name	(3R,4S,5S)-3,4-dihydroxy-5-[(1R,2R)-1,2,3-trihydroxypropyl]oxolan-2-one
Molecular Weight	208.17
Molecular Formula	C7H12O7
Canonical SMILES	C([C@H]([C@H]([C@H]1[C@H]([C@H](C(=O)O1)O)O)O)O)O
InChI	InChI=1S/C7H12O7/c8-1-2(9)3(10)6-4(11)5(12)7(13)14-6/h2-6,8-12H,1H2/t2-,3-,4+,5-,6+/m1/s1
InChI Key	VIVCRCODGMFTFY-DVKNGEFBSA-N
Boiling Point	557.5±30.0 °C
Melting Point	152-155 °C (lit.)
Purity	98%
Density	1.806±0.06 g/ml
Appearance	Solid
pKa	12.05±0.60