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1314988-55-0 | 1H-Benzimidazole, 1-(1,1-dimethylethyl)-6-propoxy-
CAS No: 1314988-55-0 Catalog No: AG000WCH MDL No:MFCD19684118
Product Description
Catalog Number:
AG000WCH
Chemical Name:
1H-Benzimidazole, 1-(1,1-dimethylethyl)-6-propoxy-
CAS Number:
1314988-55-0
Molecular Formula:
C14H20N2O
Molecular Weight:
232.3214
MDL Number:
MFCD19684118
IUPAC Name:
1-tert-butyl-6-propoxybenzimidazole
InChI:
InChI=1S/C14H20N2O/c1-5-8-17-11-6-7-12-13(9-11)16(10-15-12)14(2,3)4/h6-7,9-10H,5,8H2,1-4H3
InChI Key:
DYFLUCVVIBHZJZ-UHFFFAOYSA-N
SMILES:
CCCOc1ccc2c(c1)n(cn2)C(C)(C)C
Properties
Complexity:
249
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
232.158g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
232.327g/mol
Monoisotopic Mass:
232.158g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
27A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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