D-Gulono-1,4-lactone

C₆H₁₀O₆CAS 6322-07-2178.14 g/mol

Open in Covalent MOL file

Alcohol Ester Lactone

Properties

Molecular formula: C₆H₁₀O₆
Molar mass: 178.14 g/mol
Exact mass: 178.0477 Da
Melting point: 135–136 °C
logP: -3.01Crippen estimate
Polar surface area: 107.2 Å²
H-bond donors / acceptors: 4 / 6
Rotatable bonds: 2
Stereocentres: S, R, S, Rin SMILES atom order

Hazards

Warning

H315 Causes skin irritation50% of notifiers
H319 Causes serious eye irritation50% of notifiers
H335 May cause respiratory irritation50% of notifiers

Aggregated from 2 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

6322-07-2

SMILES

O=C1O[C@@H]([C@H](O)CO)[C@@H](O)[C@H]1O

InChIKey

SXZYCXMUPBBULW-LECHCGJUSA-N

InChI

InChI=1S/C6H10O6/c7-1-2(8)5-3(9)4(10)6(11)12-5/h2-5,7-10H,1H2/t2-,3+,4-,5+/m1/s1

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

8 names

D-Gulonic acid, γ-lactone
Gulonic acid, γ-lactone, D-
γ-D-Gulonolactone
1,4-D-Gulonolactone
D-Gulonolactone
D-Gulono-γ-lactone
NSC 34392
D-Gulonic γ-lactone

Reactions

D-GULONIC-γ-LACTONE (D-Gulonic acid, γ-lactone)product

Work with D-Gulono-1,4-lactone

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

(+)-Ribonolactone5336-08-361 % similar Glucuronolactone32449-92-651 % similar Lactobionic acid96-82-250 % similar Gluconic acid526-95-449 % similar D-Sorbose3615-56-346 % similar Psicose551-68-846 % similar Fructose57-48-746 % similar L-Fructose7776-48-946 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

Reduced ascorbate1128-23-0 Dimethyl (2S,3S)-2,3-dihydroxybutanedioate13171-64-7 Diethyl peroxydicarbonate14666-78-5 2,2′-[1,2-Ethanediylbis(oxy)]bis[acetic acid]23243-68-7 D-Galactono-1,4-lactone2782-07-2 Polyethylene glycol bis(carboxymethyl) ether39927-08-7 1,4-Dimethyl 2,3-dihydroxy- (2R,3R)butanedioate608-68-4 Glucono delta-lactone90-80-2

Elsewhere

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