Beclomethasone dipropionate

C₂₈H₃₇ClO₇CAS 5534-09-8521.05 g/mol

Open in Covalent MOL file

Alcohol Alkene Alkyl halide Ester Ketone

Properties

Molecular formula: C₂₈H₃₇ClO₇
Molar mass: 521.05 g/mol
Exact mass: 520.2228 Da
Melting point: 117–120 °C
logP: 4.09Crippen 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

H360 May damage fertility or the unborn child76.4% of notifiers
H361fd Suspected of damaging fertility; Suspected of damaging the unborn child16.4% of notifiers
H373 May causes damage to organs through prolonged or repeated exposure53.6% of notifiers

Aggregated from 110 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P203, P260, P280, P318, P319, P405, P501

Identifiers

CAS number

5534-09-8

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(Cl)[C@@H](O)C[C@@]21C

InChIKey

KUVIULQEHSCUHY-XYWKZLDCSA-N

InChI

InChI=1S/C28H37ClO7/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

57 names · show all

Ventolair
Nasobec
Clenil
Topster
Becloneb
Qvar 50
orBec
Pregna-1,4-diene-3,20-dione, 9-chloro-11-hydroxy-16-methyl-17,21-bis(1-oxopropoxy)-, (11β,16β)-
Pregna-1,4-diene-3,20-dione, 9-chloro-11β,17,21-trihydroxy-16β-methyl-, 17,21-dipropionate
(11β,16β)-9-Chloro-11-hydroxy-16-methyl-17,21-bis(1-oxopropoxy)pregna-1,4-diene-3,20-dione
Beclometasone dipropionate
9α-Chloro-16β-methylprednisolone 17,21-dipropionate
Propaderm
Beclomethasone 17,21-dipropionate
Sanasthmyl
Becotide
Vanceril
Beclometasone 17,21-dipropionate
Propaderm forte
Beclomethasone 17α,21-dipropionate
Beclomet
Beclovent
Vancenase
Beconase
Beclazone 50
Beclazone 250
Beclazone
Beclotide
Beclotide 100
Vanceril DS
Beconase AQ
Vancenase AQ
Aerobec
QVAR
Beclate
Aldecin AQ nasal
Belchlorhinol
Anceron
Viarex
Beclacin
Andion
Sch 8020W
Sanasthmax
Sanasthymyl
Aldecin
Becodisks
Viarox
Inalone O
Inalone R
Entyderma
Clenil A
Belcoforte
Becloval
Korbutone
Rino-clenil
Beclovent inhaler
Belcomet

Work with Beclomethasone 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

Betamethasone dipropionate5593-20-482 % similar Clobetasol propionate25122-46-771 % similar Mometasone105102-22-563 % similar Beclomethasone4419-39-063 % similar Mometasone furoate83919-23-762 % similar Betamethasone valerate2152-44-560 % similar Halobetasol propionate66852-54-857 % similar Dexamethasone palmitate14899-36-657 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook