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46407-94-7 | 2,2'-[(1-phenylethyl)imino]diethanol
CAS No: 46407-94-7 Catalog No: AG0072FE MDL No:
Product Description
Catalog Number:
AG0072FE
Chemical Name:
2,2'-[(1-phenylethyl)imino]diethanol
CAS Number:
46407-94-7
Molecular Formula:
C12H19NO2
Molecular Weight:
209.2848
IUPAC Name:
2-[2-hydroxyethyl(1-phenylethyl)amino]ethanol
InChI:
InChI=1S/C12H19NO2/c1-11(12-5-3-2-4-6-12)13(7-9-14)8-10-15/h2-6,11,14-15H,7-10H2,1H3
InChI Key:
PRHRISUFQISTKU-UHFFFAOYSA-N
SMILES:
OCCN(C(c1ccccc1)C)CCO
NSC Number:
78829
Properties
Complexity:
152
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
209.142g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
209.289g/mol
Monoisotopic Mass:
209.142g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
43.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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