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27684-79-3 | 2-Propanol, 1-(4-aminophenoxy)-3-[(1-methylethyl)amino]-
CAS No: 27684-79-3 Catalog No: AG002UG0 MDL No:
Product Description
Catalog Number:
AG002UG0
Chemical Name:
2-Propanol, 1-(4-aminophenoxy)-3-[(1-methylethyl)amino]-
CAS Number:
27684-79-3
Molecular Formula:
C12H20N2O2
Molecular Weight:
224.2994
IUPAC Name:
1-(4-aminophenoxy)-3-(propan-2-ylamino)propan-2-ol
InChI:
InChI=1S/C12H20N2O2/c1-9(2)14-7-11(15)8-16-12-5-3-10(13)4-6-12/h3-6,9,11,14-15H,7-8,13H2,1-2H3
InChI Key:
MBHQWSSJIBMVIA-UHFFFAOYSA-N
SMILES:
OC(COc1ccc(cc1)N)CNC(C)C
Properties
Complexity:
180
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.152g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
224.304g/mol
Monoisotopic Mass:
224.152g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
67.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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