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29734-68-7

Basic Information
CAS No.: 29734-68-7
Name: (2S,13BS)-2-METHOXY-2,3,5,6,8,9,10,13-OCTAHYDRO-1H,12H-BENZO[I]PYRANO[3,4-G]INDOLIZIN-12-ONE HYDROBROMIDE
Molecular Structure:
Molecular Structure of 29734-68-7 ((2S,13BS)-2-METHOXY-2,3,5,6,8,9,10,13-OCTAHYDRO-1H,12H-BENZO[I]PYRANO[3,4-G]INDOLIZIN-12-ONE HYDROBROMIDE)
Formula: C16H21 N O3 . Br H
Molecular Weight: 356.30
Synonyms: 16(15H)-Oxaerythrinan-15-one,1,6-didehydro-14,17-dihydro-3-methoxy-, hydrobromide, (3b)-;1H,12H-Benzo[i]pyrano[3,4-g]indolizin-12-one,2,3,5,6,8,9,10,13-octahydro-2-methoxy-, hydrobromide, (2S,13bS)- (9CI); b-Erythroidine, dihydro-,hydrobromide (6CI,7CI,8CI); 1H,12H-Benzo[i]pyrano[3,4-g]indolizin-12-one,2,3,5,6,8,9,10,13-octahydro-2-methoxy-, hydrobromide, [2S-(2R*,13bR*)]-;2,7-Dihydro-b-erythroidinehydrobromide; Dihydro-b-erythroidine hydrobromide
Melting Point: 219-229 °C (decomp)
Boiling Point: 475.5oC at 760 mmHg
Flash Point: 241.4oC
Solubility: 800 mg/mL
Appearance: white solid
Safety: A deadly poison by intravenous and intraperitoneal routes. When heated to decomposition it emits very toxic fumes of Br and NOx.
PSA: 38.77000
LogP: 2.70930
Synthetic route
29734-68-7

Dihydro-beta-erythroidine hydrobromide

23255-54-1

2,7-dihydro-β-erythroidine

Conditions
ConditionsYield
With sodium hydrogencarbonate In dichloromethane; water
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Chemistry

Molecular Formula: C16H22NO3Br
Molecular Weight: 356.30
Freely Rotating Bonds: 1
Polar Surface Area: 38.77 Å2
Flash Point: 248.1 °C
Enthalpy of Vaporization: 75.24 kJ/mol
Boiling Point: 486.6 °C at 760 mmHg
Vapour Pressure: 1.27E-09 mmHg at 25°C 
The Cas Register Number of  Dihydro-beta-erythroidine hydrobromide is 29734-68-7.The chemical synonyms of  Dihydro-beta-erythroidine hydrobromide (CAS NO.29734-68-7) are (4bS,6S)-6-Methoxy-1,4,6,7,9,10,12,13-octahydro-3H,5H-pyrano[4',3':3,4]pyrido[2,1-i]indol-3-one hydrobromide (1:1)  ; 3H,5H-pyrano[4',3':3,4]pyrido[2,1-i]indol-3-one, 1,4,6,7,9,10,12,13-octahydro-6-methoxy-, (4bS,6S)-, hydrobromide (1:1) ; Dihydro-beta-erythroidine hydrogen bromide  and  3beta-1,6-Didehydro-14,17-dihydro-3-methoxy-16(15H)-oxaerythrinan-15-one hydrobromide .The molecular structure of  Dihydro-beta-erythroidine hydrobromide (CAS NO.29734-68-7) is.

Uses

 Dihydro-beta-erythroidine hydrobromide (CAS NO.29734-68-7) is used in organic synthesis.

Toxicity Data With Reference

1.    

ipr-rat LDLo:30 mg/kg

    JPETAB    Journal of Pharmacology and Experimental Therapeutics. 75 (1942),270.
2.    

ivn-rat LD50:8900 µg/kg

    JPETAB    Journal of Pharmacology and Experimental Therapeutics. 82 (1944),266.
3.    

ivn-dog LD50:1100 µg/kg

    JPETAB    Journal of Pharmacology and Experimental Therapeutics. 82 (1944),266.
4.    

ivn-rbt LD50:2100 µg/kg

    JPETAB    Journal of Pharmacology and Experimental Therapeutics. 82 (1944),266.

Safety Profile

A deadly poison by intravenous and intraperitoneal routes. When heated to decomposition it emits very toxic fumes of Br and NOx.
Safety Statements: 22-36 
S22: Do not breathe dust. 
S36: Wear suitable protective clothing.
WGK Germany: 3
RTECS: KF3325000