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70643-19-5 | Ethanol,2-(2,4-diaminophenoxy)-
CAS No: 70643-19-5 Catalog No: AG005H74 MDL No:
Product Description
Catalog Number:
AG005H74
Chemical Name:
Ethanol,2-(2,4-diaminophenoxy)-
CAS Number:
70643-19-5
Molecular Formula:
C8H12N2O2
Molecular Weight:
168.1931
IUPAC Name:
2-(2,4-diaminophenoxy)ethanol
InChI:
InChI=1S/C8H12N2O2/c9-6-1-2-8(7(10)5-6)12-4-3-11/h1-2,5,11H,3-4,9-10H2
InChI Key:
WCPGNFONICRLCL-UHFFFAOYSA-N
SMILES:
CC(Oc1ccc(cc1N)N)O
UNII:
8DI56TBP4B
Properties
Complexity:
132
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.09g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
168.196g/mol
Monoisotopic Mass:
168.09g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
81.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1
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