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Home > Imidazoles > 69397-98-4
69397-98-4 | 1H-Benzimidazol-5-ol, 2-heptadecyl-1-methyl-
CAS No: 69397-98-4 Catalog No: AG005ZZT MDL No:
Product Description
Catalog Number:
AG005ZZT
Chemical Name:
1H-Benzimidazol-5-ol, 2-heptadecyl-1-methyl-
CAS Number:
69397-98-4
Molecular Formula:
C25H42N2O
Molecular Weight:
386.6138
IUPAC Name:
2-heptadecyl-1-methylbenzimidazol-5-ol
InChI:
InChI=1S/C25H42N2O/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-25-26-23-21-22(28)19-20-24(23)27(25)2/h19-21,28H,3-18H2,1-2H3
InChI Key:
ISZUQXCTHFZDCM-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCCCCCCc1nc2c(n1C)ccc(c2)O
Properties
Complexity:
376
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
386.33g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
386.624g/mol
Monoisotopic Mass:
386.33g/mol
Rotatable Bond Count:
16
Topological Polar Surface Area:
38A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
9.9
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