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1907-66-0

1907-66-0 | Benzenemethanol, 2,5-diethoxy-α-[1-[(1-methylethyl)amino]ethyl]-

CAS No: 1907-66-0 Catalog No: AG002EQN MDL No:

Product Description

Catalog Number:
AG002EQN
Chemical Name:
Benzenemethanol, 2,5-diethoxy-α-[1-[(1-methylethyl)amino]ethyl]-
CAS Number:
1907-66-0
Molecular Formula:
C16H27NO3
Molecular Weight:
281.3905
IUPAC Name:
1-(2,5-diethoxyphenyl)-2-(propan-2-ylamino)propan-1-ol
InChI:
InChI=1S/C16H27NO3/c1-6-19-13-8-9-15(20-7-2)14(10-13)16(18)12(5)17-11(3)4/h8-12,16-18H,6-7H2,1-5H3
InChI Key:
OJISRTSIAOBZGQ-UHFFFAOYSA-N
SMILES:
CCOc1ccc(cc1C(C(NC(C)C)C)O)OCC
NSC Number:
289335

Properties

Complexity:
260  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
281.199g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
281.396g/mol
Monoisotopic Mass:
281.199g/mol
Rotatable Bond Count:
8  
Topological Polar Surface Area:
50.7A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  

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