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74698-80-9 | 1-[(2-aminoethyl)amino]-3-(propan-2-yloxy)propan-2-ol
CAS No: 74698-80-9 Catalog No: AG005IF8 MDL No:
Product Description
Catalog Number:
AG005IF8
Chemical Name:
1-[(2-aminoethyl)amino]-3-(propan-2-yloxy)propan-2-ol
CAS Number:
74698-80-9
Molecular Formula:
C8H20N2O2
Molecular Weight:
176.2566
IUPAC Name:
1-(2-aminoethylamino)-3-propan-2-yloxypropan-2-ol
InChI:
InChI=1S/C8H20N2O2/c1-7(2)12-6-8(11)5-10-4-3-9/h7-8,10-11H,3-6,9H2,1-2H3
InChI Key:
KJPUNPWQEHPNGQ-UHFFFAOYSA-N
SMILES:
NCCNCC(COC(C)C)O
NSC Number:
44074
Properties
Complexity:
99.1
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
176.152g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
176.26g/mol
Monoisotopic Mass:
176.152g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
67.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.1
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