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Home > Imidazoles > 5805-33-4
5805-33-4 | Benzimidazole, 2-(1-cyclohexen-1-yl)- (7CI,8CI)
CAS No: 5805-33-4 Catalog No: AG00EO6M MDL No:
Product Description
Catalog Number:
AG00EO6M
Chemical Name:
Benzimidazole, 2-(1-cyclohexen-1-yl)- (7CI,8CI)
CAS Number:
5805-33-4
IUPAC Name:
2-methoxyethyl 2,7,7-trimethyl-5-oxo-4-thiophen-2-yl-1,4,6,8-tetrahydroquinoline-3-carboxylate
InChI:
InChI=1S/C20H25NO4S/c1-12-16(19(23)25-8-7-24-4)18(15-6-5-9-26-15)17-13(21-12)10-20(2,3)11-14(17)22/h5-6,9,18,21H,7-8,10-11H2,1-4H3
InChI Key:
HLPMALILYUAEEE-UHFFFAOYSA-N
Properties
Complexity:
665
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
375.15g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
375.483g/mol
Monoisotopic Mass:
375.15g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
92.9A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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