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2153-98-2

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Basic Information
CAS No.: 2153-98-2
Name: Norpseudoephedrine hydrochloride
Article Data: 9
Molecular Structure:
Molecular Structure of 2153-98-2 (Norpseudoephedrine hydrochloride)
Formula: C9H13 N O . Cl H
Molecular Weight: 187.669
Synonyms: Benzenemethanol,a-(1-aminoethyl)-, hydrochloride,[S-(R*,R*)]-; Benzenemethanol, a-[(1S)-1-aminoethyl]-, hydrochloride, (aS)- (9CI); Norpseudoephedrine, hydrochloride(6CI,7CI); Norpseudoephedrine, hydrochloride, (+)- (8CI);(1S,2S)-(+)-Pseudonorephedrine hydrochloride; (S)-(+)-Norpseudoephedrinehydrochloride; Adiposetten; Amorphan; Cathine hydrochloride; Exponcit N;Fasupond; Fugoa; L-Norpseudoephedrine hydrochloride; Minusin;d-Norpseudoephedrine hydrochloride; threo-2-Amino-1-hydroxy-1-phenylpropanehydrochloride
EINECS: 218-446-1
Melting Point: 172-175 °C
Flash Point: 9℃
Solubility: H2O: ~20 mg/mL
Appearance: solid ,white
Hazard Symbols:
Risk Codes: R22   
Safety: Poison by intraperitoneal, subcutaneous and intravenous routes. When heated to decomposition it emits very toxic fumes of HCl and NOx.
PSA: 46.25000
LogP: 2.56950
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Chemistry

Molecular Formula: C9H14ClNO
Molar mass: 187.67 g/mol
EINECS: 207-754-1
Flash Point: 147.9 °C
Boiling Point: 321 °C at 760 mmHg
Vapour Pressure: 0.000127 mmHg at 25 °C
Water solubility: ~20 mg/mL
Structure of (+)-Norpseudoephedrine hydrochloride (CAS NO.2153-98-2):
                        
H-Bond Donor: 3
H-Bond Acceptor: 2
IUPAC Name of (+)-Norpseudoephedrine hydrochloride (CAS NO.2153-98-2): (1S,2S)-2-Amino-1-phenylpropan-1-ol hydrochloride
Canonical SMILES: CC(C(C1=CC=CC=C1)O)N.Cl
Isomeric SMILES: C[C@@H]([C@H](C1=CC=CC=C1)O)N.Cl
InChI: InChI=1S/C9H13NO.ClH/c1-7(10)9(11)8-5-3-2-4-6-8;/h2-7,9,11H,10H2,1H3;1H/t7-,9+;/m0./s1 
InChIKey: DYWNLSQWJMTVGJ-DKXTVVGFSA-N

Toxicity Data With Reference

1.    

ipr-mus LD50:161 mg/kg

    JPETAB    Journal of Pharmacology and Experimental Therapeutics. 158 (1967),135.
2.    

scu-mus LD50:275 mg/kg

    ARZNAD    Arzneimittel-Forschung. Drug Research. 5 (1955),367.
3.    

ivn-rbt LDLo:75 mg/kg

    JPETAB    Journal of Pharmacology and Experimental Therapeutics. 36 (1929),363.

Consensus Reports

Reported in EPA TSCA Inventory.

Safety Profile

Poison by intraperitoneal, subcutaneous and intravenous routes. When heated to decomposition it emits very toxic fumes of HCl and NOx.
 

Hazard Codes of (+)-Norpseudoephedrine hydrochloride (CAS NO.2153-98-2): HarmfulXn
Risk Statements:
R22:Harmful if swallowed.

Specification

 (+)-Norpseudoephedrine hydrochloride ,its cas register number is 2153-98-2. It also can be called Exponcit ; Norpseudoephedrine hydrochloride ; S,S-Norpseudoephedrine hydrochloride ; Cathine hydrochloride ; Benzenemethanol, alpha-[(1R)-1-aminoethyl]-, (alphaR)-, hydrochloride (1:1) and (1R,2R)-2-amino-1-phenylpropan-1-ol hydrochloride (1:1) .