Morphine

C₁₇H₁₉NO₃CAS 57-27-2285.34 g/mol

Open in Covalent MOL file

Alcohol Alkene Ether Phenol Tertiary amine

Properties

Molecular formula: C₁₇H₁₉NO₃
Molar mass: 285.34 g/mol
Exact mass: 285.1365 Da
Melting point: 255 °C
pKa: 8.21 (25 °C), 9.85 (20 °C)
Water solubility: insoluble
logP: 1.20Crippen estimate
Polar surface area: 52.9 Å²
H-bond donors / acceptors: 2 / 4
Rotatable bonds: 0
Stereocentres: S, R, R, R, Sin SMILES atom order

Hazards

Warning

H302 Harmful if swallowed98.6% of notifiers
H317 May cause an allergic skin reaction27.8% of notifiers
H336 May cause drowsiness or dizziness38.9% of notifiers
H361 Suspected of damaging fertility or the unborn child27.8% of notifiers
H361fd Suspected of damaging fertility; Suspected of damaging the unborn child25% of notifiers
H362 May cause harm to breast-fed children26.4% of notifiers

Aggregated from 72 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P203, P260, P261, P263, P264, P270, P271, P272, P280, P301+P317, P302+P352, P304+P340, P318, P319, P321, P330, P333+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

57-27-2

SMILES

CN1CC[C@]23[C@@H]4[C@H]1CC5=C2C(=C(C=C5)O)O[C@H]3[C@H](C=C4)O

InChIKey

BQJCRHHNABKAKU-KBQPJGBKSA-N

InChI

InChI=1S/C17H19NO3/c1-18-7-6-17-10-3-5-13(20)16(17)21-15-12(19)4-2-9(14(15)17)8-11(10)18/h2-5,10-11,13,16,19-20H,6-8H2,1H3/t10-,11+,13-,16-,17-/m0/s1

Weigh it out

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

Names and synonyms

16 names · show all

(4R,4aR,7S,7aR,12bS)-3-methyl-2,4,4a,7,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline-7,9-diol
Morphia
Morphium
Morphina
(-)-Morphine
Morphinum
Ospalivina
Morphin
Duromorph
Meconium
Morphinism
Nepenthe
Dulcontin
Roxanol
Morfina
Morpho

Work with Morphine

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

Sinomenine115-53-735 % similar Sinomenine hydrochloride6080-33-734 % similar Naloxegol oxalate1354744-91-430 % similar Dextromethorphan125-71-330 % similar

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

Same formula

Rel-(4aR,8aR)-4a,5,9,10,11,12-Hexahydro-3-methoxy-11-methyl-6H-benzofuro[3a,3,2-ef][2]benzazepin-6-one1668-86-6 Narwedine510-77-0 Cbz-D-phenylalaninol58917-85-4 (S)-Cbz-phenylalaninol6372-14-1 5-(1,3-Benzodioxol-5-yl)-1-(1-piperidinyl)-2,4-pentadien-1-one7780-20-3 2′,5′-Diethoxybenzanilide92-22-8 Piperine94-62-2

Elsewhere

PubChem CAS Common Chemistry NIST WebBook