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114460-13-8 | 2-Propanol, 1-[4-(hydroxyamino)phenoxy]-3-[(1-methylethyl)amino]-
CAS No: 114460-13-8 Catalog No: AG000EGC MDL No:
Product Description
Catalog Number:
AG000EGC
Chemical Name:
2-Propanol, 1-[4-(hydroxyamino)phenoxy]-3-[(1-methylethyl)amino]-
CAS Number:
114460-13-8
Molecular Formula:
C12H20N2O3
Molecular Weight:
240.2988
IUPAC Name:
1-[4-(hydroxyamino)phenoxy]-3-(propan-2-ylamino)propan-2-ol
InChI:
InChI=1S/C12H20N2O3/c1-9(2)13-7-11(15)8-17-12-5-3-10(14-16)4-6-12/h3-6,9,11,13-16H,7-8H2,1-2H3
InChI Key:
UCGFOKKVSOLRAB-UHFFFAOYSA-N
SMILES:
ONc1ccc(cc1)OCC(CNC(C)C)O
Properties
Complexity:
194
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
240.147g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
240.303g/mol
Monoisotopic Mass:
240.147g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
73.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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