Hoffer'S chlorosugar
Properties
- Molecular formula
- C21H21ClO5
- Molar mass
- 388.84 g/mol
- Exact mass
- 388.1078 Da
- Melting point
- 117–119 °C
- logP
- 4.04Crippen estimate
- Polar surface area
- 61.8 Ų
- H-bond donors / acceptors
- 0 / 5
- Rotatable bonds
- 5
- Stereocentres
- R, R, Sin SMILES atom order
Hazards
Warning
- H315 Causes skin irritation100% of notifiers
- H319 Causes serious eye irritation100% of notifiers
- H335 May cause respiratory irritation97.6% of notifiers
Aggregated from 42 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
4330-21-6SMILES
Cc1ccc(C(=O)OC[C@H]2O[C@H](Cl)C[C@@H]2OC(=O)c2ccc(C)cc2)cc1InChIKey
FJHSYOMVMMNQJQ-OTWHNJEPSA-NInChI
InChI=1S/C21H21ClO5/c1-13-3-7-15(8-4-13)20(23)25-12-18-17(11-19(22)26-18)27-21(24)16-9-5-14(2)6-10-16/h3-10,17-19H,11-12H2,1-2H3/t17-,18+,19-/m0/s1Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
15 names · show all
- α-D-Erythro-Pentofuranosyl chloride, 2-deoxy-, 3,5-bis(4-methylbenzoate)
- D-Erythro-Pentofuranosyl chloride, 2-deoxy-, di-p-toluate, α-
- α-D-Erythro-Pentofuranosyl chloride, 2-deoxy-, bis(4-methylbenzoate)
- p-Toluic acid, diester with 2-deoxy-α-D-erythro-pentofuranosyl chloride
- 3,5-Di-O-p-toluyl-2-deoxy-α-D-ribofuranosyl chloride
- 1-Chloro-2-deoxy-3,5-di-O-p-toluoyl-α-D-erythro-pentofuranose
- 2-Deoxy-3,5-di-O-p-toluoyl-α-D-erythro-pentofuranosyl chloride
- NSC 148837
- Hoffer's α-chlorosugar
- 1-Chloro-2-deoxy-3,5-di-O-p-toluoyl-α-D-ribose
- Hoffer's sugar
- (2R,3S,5R)-5-Chloro-2-[[(4-methylbenzoyl)oxy]methyl]tetrahydrofuran-3-yl] 4-methylbenzoate
- 3,5-Di-O-toluoyl-α-1-chloro-2-deoxy-D-ribofuranose
- 1-Chloro-2-deoxy-3,5-di-O-toluoyl-a-D-ribofuranose
- 1-α-Chloro-3,5-ditoluoyl-2-deoxy-D-ribose
Work with Hoffer'S chlorosugar
Similar compounds
2-Deoxy-3,5-di-O-(p-chlorobenzoyl)-α-D-erythro-pentofuranosyl chloride21740-23-876 % similar
1-O-Acetyl-3,5-bis(4-chlorobenzoyl)-2-deoxy-D-ribose1207459-15-154 % similar
Ethyl 4-methylbenzoate94-08-647 % similar
(-)-Di-P-toluoyl-L-tartaric acid32634-66-543 % similar
(+)-Di-P-toluoyl-D-tartaric acid32634-68-743 % similar
Butanedioic acid, 2,3-bis[(4-methylbenzoyl)oxy]-, hydrate (1:1), (2S,3S)-71607-31-340 % similar
Butanedioic acid, 2,3-bis[(4-methylbenzoyl)oxy]-, hydrate (1:1), (2R,3R)-71607-32-440 % similar
Methyl P-toluate99-75-240 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds