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Name	Codeine phosphate sesquihydrate	EINECS	N/A
CAS No.	5913-76-8	Density	g/cm³
PSA	286.69000	LogP	0.82790
Solubility	N/A	Melting Point	N/A
Formula	C₁₈H₂₁NO₃•H₃O₄P•3/2H₂O	Boiling Point	462°Cat760mmHg
Molecular Weight	424.38	Flash Point	233.2°C
Transport Information	N/A	Appearance	N/A
Safety	Poison by ingestion, subcutaneous, intravenous, and intraperitoneal routes. When heated to decomposition it emits toxic fumes of NO_x and PO_x. A narcotic analgesic and antitussive. See also CODEINE and CODEINE PHOSPHATE.	Risk Codes	N/A
Molecular Structure		Hazard Symbols	N/A
Synonyms	CODEINE PHOSPHATE, SEQUIHYDRATE)

Codeine phosphate sesquihydrate Chemical Properties

Molecular Structure of Codeine phosphate sesquihydrate (CAS NO. 5913-76-8):

Molecular Formula: C₃₆H₅₄N₂O₁₇P₂
Molecular Weight: 848.764682 g/mol
H-Bond Donor: 11
H-Bond Acceptor: 19
Isomeric SMILES: CN1CC[C@]23[C@@H]4[C@H]1CC5=C2C(=C(C=C5)OC)O[C@H]3[C@H](C=C4)O.CN1CC[C@]23[C@@H]4[C@H]1CC5=C2C(=C(C=C5)OC)O[C@H]3[C@H](C=C4)O.O.O.O.OP(=O)(O)O.OP(=O)(O)O
InChI: 1S/2C18H21NO3.2H3O4P.3H2O/c2*1-19-8-7-18-11-4-5-13(20)17(18)22-16-14(21-2)6-3-10(15(16)18)9-12(11)19;2*1-5(2,3)4;;;/h2*3-6,11-13,17,20H,7-9H2,1-2H3;2*(H3,1,2,3,4);3*1H2/t2*11-,12+,13-,17-,18-;;;;;/m00...../s1
InChIKey: UDIMULCGRYVAIM-REWFBLHLSA-N
Flash Point: 233.2 °C
Enthalpy of Vaporization: 76.18 kJ/mol
Boiling Point: 462 °C at 760 mmHg
Vapour Pressure of Codeine phosphate sesquihydrate (CAS NO. 5913-76-8): 2.47E-09 mmHg at 25 °C

Codeine phosphate sesquihydrate Toxicity Data With Reference

1.	orl-rat LD50:209 mg/kg	KSRNAM Kiso to Rinsho. Clinical Report. 5 (1971),1011.
2.	ipr-rat LD50:38 mg/kg	KSRNAM Kiso to Rinsho. Clinical Report. 5 (1971),1011.
3.	scu-rat LD50:81 mg/kg	KSRNAM Kiso to Rinsho. Clinical Report. 5 (1971),1011.
4.	orl-mus LD50:290 mg/kg	KSRNAM Kiso to Rinsho. Clinical Report. 5 (1971),1787.
5.	ipr-mus LD50:83 mg/kg	KSRNAM Kiso to Rinsho. Clinical Report. 5 (1971),1011.
6.	scu-mus LD50:191 mg/kg	YKKZAJ Yakugaku Zasshi. Journal of Pharmacy. 81 (1961),740.
7.	ivn-mus LD50:70 mg/kg	KSRNAM Kiso to Rinsho. Clinical Report. 5 (1971),1787.
8.	ivn-dog LD50:97,800 µg/kg	YKKZAJ Yakugaku Zasshi. Journal of Pharmacy. 81 (1961),740.
9.	orl-rbt LDLo:100 mg/kg	MEIEDD Merck Index. 10 (1983),350.

Codeine phosphate sesquihydrate Safety Profile

Poison by ingestion, subcutaneous, intravenous, and intraperitoneal routes. When heated to decomposition it emits toxic fumes of NO_x and PO_x. A narcotic analgesic and antitussive. See also CODEINE and CODEINE PHOSPHATE.

Codeine phosphate sesquihydrate Specification

Codeine phosphate sesquihydrate with cas registry number of 5913-76-8 is also known as Morphinan-6-alpha-ol, 7,8-didehydro-4,5-alpha-epoxy-3-methoxy-17-methyl-, phosphate, sesquihydrate (3:3:2) .

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