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2-Propanol,1-[(1-methylethyl)amino]-3-(1-naphthalenyloxy)-, hydrochloride (1:1), (2R)-

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Name

2-Propanol,1-[(1-methylethyl)amino]-3-(1-naphthalenyloxy)-, hydrochloride (1:1), (2R)-

EINECS 235-961-7
CAS No. 13071-11-9 Density
Solubility Melting Point 196-198 °C(lit.)
Formula C16H21NO2.ClH Boiling Point 434.9 °C at 760 mmHg
Molecular Weight 295.81 Flash Point 216.8 °C
Transport Information Appearance
Safety 22-24/25 Risk Codes 22
Molecular Structure Molecular Structure of 13071-11-9 (2-Propanol,1-[(1-methylethyl)amino]-3-(1-naphthalenyloxy)-, hydrochloride (1:1), (2R)-) Hazard Symbols HarmfulXn
Synonyms

2-Propanol,1-(isopropylamino)-3-(1-naphthyloxy)-, hydrochloride, (+)- (8CI);2-Propanol,1-[(1-methylethyl)amino]-3-(1-naphthalenyloxy)-, hydrochloride, (2R)- (9CI);2-Propanol, 1-[(1-methylethyl)amino]-3-(1-naphthalenyloxy)-, hydrochloride,(R)-;(+)-1-(Isopropylamino)-3-(1-naphthyloxy)-2-propanol hydrochloride;(+)-Anapriline;(+)-Propranolol hydrochloride;(R)-(+)-Propranolol hydrochloride;(R)-Propranolol hydrochloride;AY 20694;Dexpropranolol hydrochloride;ICI47319;R-(+)-1-Isopropylamino-3-(1-naphthoxy)-2-propanol hydrochloride;d-Anapriline;d-Propranolol hydrochloride;

 

2-Propanol,1-[(1-methylethyl)amino]-3-(1-naphthalenyloxy)-, hydrochloride (1:1), (2R)- Specification

The CAS register number of 2-Propanol,1-[(1-methylethyl)amino]-3-(1-naphthalenyloxy)-, hydrochloride (1:1), (2R)- is 13071-11-9. It also can be called as (R)-(+)-Propranolol hydrochloride and the IUPAC name about this chemical is (2R)-1-naphthalen-1-yloxy-3-(propan-2-ylamino)propan-2-ol hydrochloride. The molecular formula about this chemical is C16H21NO2.ClH and the molecular weight is 295.81.

Physical properties about 2-Propanol,1-[(1-methylethyl)amino]-3-(1-naphthalenyloxy)-, hydrochloride (1:1), (2R)- are: (1)ACD/LogP: 3.10; (2)ACD/LogD (pH 5.5): 0.09; (3)ACD/LogD (pH 7.4): 1.27; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 2; (6)ACD/KOC (pH 5.5): 1.13; (7)ACD/KOC (pH 7.4): 17.36; (8)#H bond acceptors: 3; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 7; (11)Polar Surface Area: 21.7 Å2; (12)Flash Point: 216.8 °C; (13)Enthalpy of Vaporization: 72.84 kJ/mol; (14)Boiling Point: 434.9 °C at 760 mmHg; (15)Vapour Pressure: 2.48E-08 mmHg at 25 °C.

When you are using this chemical, please be cautious about it as the following:
This chemical is harmful if swallowed and it may cause damage to health. If you want to use it, do not breathe dust and avoid contact with skin and eyes. This chemical may have harm to the environment, especially when discharged into water and the storage temperature of this chemical is 2-8 °C.

You can still convert the following datas into molecular structure:
(1)SMILES: Cl.O[C@H](CNC(C)C)COc2cccc1ccccc12
(2)InChI: InChI=1/C16H21NO2.ClH/c1-12(2)17-10-14(18)11-19-16-9-5-7-13-6-3-4-8-15(13)16;/h3-9,12,14,17-18H,10-11H2,1-2H3;1H/t14-;/m1./s1
(3)InChIKey: ZMRUPTIKESYGQW-PFEQFJNWBV
(4)Std. InChI: InChI=1S/C16H21NO2.ClH/c1-12(2)17-10-14(18)11-19-16-9-5-7-13-6-3-4-8-15(13)16;/h3-9,12,14,17-18H,10-11H2,1-2H3;1H/t14-;/m1./s1
(5)Std. InChIKey: ZMRUPTIKESYGQW-PFEQFJNWSA-N

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