Betamethasone dipropionate

C₂₈H₃₇FO₇CAS 5593-20-4504.60 g/mol

Open in Covalent MOL file

Alcohol Alkene Alkyl halide Ester Ketone

Properties

Molecular formula: C₂₈H₃₇FO₇
Molar mass: 504.60 g/mol
Exact mass: 504.2523 Da
Melting point: 232 °C (decomposes)
logP: 3.82Crippen estimate
Polar surface area: 107.0 Å²
H-bond donors / acceptors: 1 / 7
Rotatable bonds: 6
Stereocentres: R, S, S, S, S, R, S, Sin SMILES atom order

Hazards

Danger

H330 Fatal if inhaled40.9% of notifiers
H360 May damage fertility or the unborn child37.8% of notifiers
H360D May damage the unborn child13.4% of notifiers
H361 Suspected of damaging fertility or the unborn child45.7% of notifiers
H372 Causes damage to organs through prolonged or repeated exposure50.4% of notifiers
H410 Very toxic to aquatic life with long lasting effects50.4% of notifiers

Aggregated from 127 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P203, P260, P264, P270, P271, P273, P280, P284, P304+P340, P316, P318, P319, P320, P391, P403+P233, P405, P501

Identifiers

CAS number

5593-20-4

SMILES

CCC(=O)OCC(=O)[C@@]1(OC(=O)CC)[C@@H](C)C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@@]21C

InChIKey

CIWBQSYVNNPZIQ-XYWKZLDCSA-N

InChI

InChI=1S/C28H37FO7/c1-6-23(33)35-15-22(32)28(36-24(34)7-2)16(3)12-20-19-9-8-17-13-18(30)10-11-25(17,4)27(19,29)21(31)14-26(20,28)5/h10-11,13,16,19-21,31H,6-9,12,14-15H2,1-5H3/t16-,19-,20-,21-,25-,26-,27-,28-/m0/s1

Weigh it out

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

Names and synonyms

17 names · show all

β-Methasone 17,21-dipropionate
Pregna-1,4-diene-3,20-dione, 9-fluoro-11-hydroxy-16-methyl-17,21-bis(1-oxopropoxy)-, (11β,16β)-
Pregna-1,4-diene-3,20-dione, 9-fluoro-11β,17,21-trihydroxy-16β-methyl-, 17,21-dipropionate
(11β,16β)-9-Fluoro-11-hydroxy-16-methyl-17,21-bis(1-oxopropoxy)pregna-1,4-diene-3,20-dione
Diprosone
S 3440
Diproderm
Betamethasone 17,21-dipropionate
Diprolene
Diprosis
Psorion
Maxivate
Rinderon DP
Diprophos
Sch 11460
Diprospan
Diprosen

Work with Betamethasone dipropionate

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

Clobetasol propionate25122-46-784 % similar Beclomethasone dipropionate5534-09-882 % similar Betamethasone valerate2152-44-573 % similar Dexamethasone palmitate14899-36-669 % similar Dexamethasone acetate1177-87-367 % similar Betamethasone acetate987-24-667 % similar Halobetasol propionate66852-54-865 % similar Betamethasone378-44-963 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

PubChem CAS Common Chemistry NIST WebBook