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Home > Imidazoles > 189056-68-6
189056-68-6 | Phenol, 4-[2-(6-methyl-1H-benzimidazol-2-yl)ethenyl]-
CAS No: 189056-68-6 Catalog No: AG002HSV MDL No:
Product Description
Catalog Number:
AG002HSV
Chemical Name:
Phenol, 4-[2-(6-methyl-1H-benzimidazol-2-yl)ethenyl]-
CAS Number:
189056-68-6
Molecular Formula:
C16H14N2O
Molecular Weight:
250.2952
IUPAC Name:
4-[2-(6-methyl-1H-benzimidazol-2-yl)ethenyl]phenol
InChI:
InChI=1S/C16H14N2O/c1-11-2-8-14-15(10-11)18-16(17-14)9-5-12-3-6-13(19)7-4-12/h2-10,19H,1H3,(H,17,18)
InChI Key:
FHDQVFVZFNXKKO-UHFFFAOYSA-N
SMILES:
Oc1ccc(cc1)C=Cc1nc2c([nH]1)cc(cc2)C
Properties
Complexity:
323
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
250.111g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
250.301g/mol
Monoisotopic Mass:
250.111g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
48.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
3.8
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