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188907-02-0 | Phenol, 4-chloro-2-[[[2-(ethylamino)ethyl]imino]methyl]-
CAS No: 188907-02-0 Catalog No: AG002HI6 MDL No:
Product Description
Catalog Number:
AG002HI6
Chemical Name:
Phenol, 4-chloro-2-[[[2-(ethylamino)ethyl]imino]methyl]-
CAS Number:
188907-02-0
Molecular Formula:
C11H15ClN2O
Molecular Weight:
226.7026
IUPAC Name:
4-chloro-2-[2-(ethylamino)ethyliminomethyl]phenol
InChI:
InChI=1S/C11H15ClN2O/c1-2-13-5-6-14-8-9-7-10(12)3-4-11(9)15/h3-4,7-8,13,15H,2,5-6H2,1H3
InChI Key:
ZDNVXKXFYNFKLU-UHFFFAOYSA-N
SMILES:
CCNCCN=Cc1cc(Cl)ccc1O
Properties
Complexity:
199
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.087g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
226.704g/mol
Monoisotopic Mass:
226.087g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
44.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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