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80200-00-6 | Phenol, 4-[2-(1H-benzimidazol-1-yl)ethoxy]-
CAS No: 80200-00-6 Catalog No: AG005CAS MDL No:
Product Description
Catalog Number:
AG005CAS
Chemical Name:
Phenol, 4-[2-(1H-benzimidazol-1-yl)ethoxy]-
CAS Number:
80200-00-6
Molecular Formula:
C15H14N2O2
Molecular Weight:
254.2839
IUPAC Name:
4-[2-(benzimidazol-1-yl)ethoxy]phenol
InChI:
InChI=1S/C15H14N2O2/c18-12-5-7-13(8-6-12)19-10-9-17-11-16-14-3-1-2-4-15(14)17/h1-8,11,18H,9-10H2
InChI Key:
YCONEPHMWFPQSP-UHFFFAOYSA-N
SMILES:
Oc1ccc(cc1)OCCn1cnc2c1cccc2
Properties
Complexity:
279
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
254.106g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
254.289g/mol
Monoisotopic Mass:
254.106g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
47.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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