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56135-64-9

56135-64-9 | 1-(Benzyloxy)-3-(isopropylamino)-propan-2-ol hydrochloride

CAS No: 56135-64-9 Catalog No: AG01FM50 MDL No:MFCD00183220

Product Description

Catalog Number:
AG01FM50
Chemical Name:
1-(Benzyloxy)-3-(isopropylamino)-propan-2-ol hydrochloride
CAS Number:
56135-64-9
Molecular Formula:
C13H22ClNO2
Molecular Weight:
259.7723
MDL Number:
MFCD00183220
IUPAC Name:
1-phenylmethoxy-3-(propan-2-ylamino)propan-2-ol;hydrochloride
InChI:
InChI=1S/C13H21NO2.ClH/c1-11(2)14-8-13(15)10-16-9-12-6-4-3-5-7-12;/h3-7,11,13-15H,8-10H2,1-2H3;1H
InChI Key:
UWJOACJFMGVNNN-UHFFFAOYSA-N
SMILES:
OC(COCc1ccccc1)CNC(C)C.Cl

Properties

Complexity:
167  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
259.134g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
259.774g/mol
Monoisotopic Mass:
259.134g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
41.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0

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