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14817-40-4

14817-40-4 | 2-Propanol, 1-[(1-methylethyl)amino]-3-[2-(2-propyn-1-yloxy)phenoxy]-

CAS No: 14817-40-4 Catalog No: AG001FIH MDL No:

Product Description

Catalog Number:
AG001FIH
Chemical Name:
2-Propanol, 1-[(1-methylethyl)amino]-3-[2-(2-propyn-1-yloxy)phenoxy]-
CAS Number:
14817-40-4
Molecular Formula:
C15H21NO3
Molecular Weight:
263.3321
IUPAC Name:
1-(propan-2-ylamino)-3-(2-prop-2-ynoxyphenoxy)propan-2-ol
InChI:
InChI=1S/C15H21NO3/c1-4-9-18-14-7-5-6-8-15(14)19-11-13(17)10-16-12(2)3/h1,5-8,12-13,16-17H,9-11H2,2-3H3
InChI Key:
FYOGTFROMBUNKU-UHFFFAOYSA-N
SMILES:
C#CCOc1ccccc1OCC(CNC(C)C)O

Properties

Complexity:
284  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
263.152g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
263.337g/mol
Monoisotopic Mass:
263.152g/mol
Rotatable Bond Count:
8  
Topological Polar Surface Area:
50.7A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  

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