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89175-33-7 | 1H-Imidazole, 1-[2-[(2,4-dichlorophenyl)methyl]-3,3-dimethyl-1-butenyl]-
CAS No: 89175-33-7 Catalog No: AG003WA9 MDL No:
Product Description
Catalog Number:
AG003WA9
Chemical Name:
1H-Imidazole, 1-[2-[(2,4-dichlorophenyl)methyl]-3,3-dimethyl-1-butenyl]-
CAS Number:
89175-33-7
Molecular Formula:
C16H18Cl2N2
Molecular Weight:
309.2335
IUPAC Name:
1-[2-[(2,4-dichlorophenyl)methyl]-3,3-dimethylbut-1-enyl]imidazole
InChI:
InChI=1S/C16H18Cl2N2/c1-16(2,3)13(10-20-7-6-19-11-20)8-12-4-5-14(17)9-15(12)18/h4-7,9-11H,8H2,1-3H3
InChI Key:
VBMQQAGRVPRRRC-UHFFFAOYSA-N
SMILES:
Clc1ccc(c(c1)Cl)CC(=Cn1cncc1)C(C)(C)C
Properties
Complexity:
349
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
308.085g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
309.234g/mol
Monoisotopic Mass:
308.085g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
17.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
5.6
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