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89514-97-6 | 2-Propanol, 1-[(2-amino-1,1-dimethylethyl)amino]-3-(2-methylphenoxy)-
CAS No: 89514-97-6 Catalog No: AG00417G MDL No:
Product Description
Catalog Number:
AG00417G
Chemical Name:
2-Propanol, 1-[(2-amino-1,1-dimethylethyl)amino]-3-(2-methylphenoxy)-
CAS Number:
89514-97-6
Molecular Formula:
C14H24N2O2
Molecular Weight:
252.3526
IUPAC Name:
1-[(1-amino-2-methylpropan-2-yl)amino]-3-(2-methylphenoxy)propan-2-ol
InChI:
InChI=1S/C14H24N2O2/c1-11-6-4-5-7-13(11)18-9-12(17)8-16-14(2,3)10-15/h4-7,12,16-17H,8-10,15H2,1-3H3
InChI Key:
IYSQBEFEGDQORJ-UHFFFAOYSA-N
SMILES:
NCC(NCC(COc1ccccc1C)O)(C)C
Properties
Complexity:
234
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
252.184g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
252.358g/mol
Monoisotopic Mass:
252.184g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
67.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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