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80199-99-1 | Phenol, 4-[2-(1H-imidazol-1-yl)ethoxy]-
CAS No: 80199-99-1 Catalog No: AG0054DH MDL No:
Product Description
Catalog Number:
AG0054DH
Chemical Name:
Phenol, 4-[2-(1H-imidazol-1-yl)ethoxy]-
CAS Number:
80199-99-1
Molecular Formula:
C11H12N2O2
Molecular Weight:
204.2252
IUPAC Name:
4-(2-imidazol-1-ylethoxy)phenol
InChI:
InChI=1S/C11H12N2O2/c14-10-1-3-11(4-2-10)15-8-7-13-6-5-12-9-13/h1-6,9,14H,7-8H2
InChI Key:
QNZJCINSASAQMW-UHFFFAOYSA-N
SMILES:
Oc1ccc(cc1)OCCn1cncc1
Properties
Complexity:
181
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.09g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
204.229g/mol
Monoisotopic Mass:
204.09g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
47.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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