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Home> Hot Product Listed M   > morphine tartrate
129-09-9 structure

morphine tartrate

CAS No.:129-09-9
Molecular Weight:474.55300
Molecular Formula:C16H18N4O3 (isomer)
Names and Identifiers
Synonyms

(5alpha,6alpha)-17-methyl-7,8-didehydro-4,5-epoxymorphinan-3,6-diol 2,3-dihydroxybutanedioate (2:1) (salt)

Inchi
InChI=1S/C28H14N2O2S2/c31-23-18-12-14-20-26(34-28(30-20)16-9-5-2-6-10-16)22(18)24(32)17-11-13-19-25(21(17)23)33-27(29-19)15-7-3-1-4-8-15/h1-14H
InChkey
GFFQNEGBFFGLQG-UHFFFAOYSA-N
Canonical Smiles
C1=CC=C(C=C1)C2=NC3=C(S2)C4=C(C=C3)C(=O)C5=C(C4=O)C=CC6=C5SC(=N6)C7=CC=CC=C7
Properties
Density
1.68
Vapour
5.25E-21mmHg at 25°C
Refractive Index
1.786
HS Code
2934100090
Reach Info
Globally, no enterprise has officially registered the substance REACH.
Other official information: ·ECHA Information Page for CAS: 129-09-9 EC: morphine tartrate ·ECHA C&L Inventory for CAS: CAS: 129-09-9 EC: morphine tartrate
MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

Not classified.

2.2 GHS label elements, including precautionary statements

Pictogram(s) No symbol.
Signal word

No signal word.

Hazard statement(s)

none

Precautionary statement(s)
Prevention

none

Response

none

Storage

none

Disposal

none

2.3 Other hazards which do not result in classification

none

Computational chemical data
  • Molecular Weight:474.55300g/mol
  • Molecular Formula:C16H18N4O3
  • Compound Is Canonicalized:True
  • Exact Mass:474.05
  • Monoisotopic Mass:474.05
  • Complexity:744
  • Rotatable Bond Count:2
  • Hydrogen Bond Donor Count:0
  • Hydrogen Bond Acceptor Count:6
  • Topological Polar Surface Area:116A^2
  • Heavy Atom Count:34
  • Defined Atom Stereocenter Count:0
  • Undefined Atom Stereocenter Count:0
  • Defined Bond Stereocenter Count:0
  • Undefined Bond Stereocenter Count:0
  • Isotope Atom Count:0
  • Covalently-Bonded Unit Count:1
  • CACTVS Substructure Key Fingerprint: AAADccB7MABgAAAAAAAAAAAAAAAAAWLAAAAwYMGDAAAAAFjB/gAAHgQAAAAADAyB3gAwwbIIEAis A6RyRACD8KBlCjgImDUwZNgIILLglZGEIQhggADoyYcdicCeiAAAwAAUAQCQAAWAACgCAAAAAAAA AA==
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