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89764-52-3 | Furan, 4-[4-(4-chlorophenyl)-4-methylpentyl]-2-(phenylmethyl)-
CAS No: 89764-52-3 Catalog No: AG0040MK MDL No:
Product Description
Catalog Number:
AG0040MK
Chemical Name:
Furan, 4-[4-(4-chlorophenyl)-4-methylpentyl]-2-(phenylmethyl)-
CAS Number:
89764-52-3
Molecular Formula:
C23H25ClO
Molecular Weight:
352.8970
IUPAC Name:
2-benzyl-4-[4-(4-chlorophenyl)-4-methylpentyl]furan
InChI:
InChI=1S/C23H25ClO/c1-23(2,20-10-12-21(24)13-11-20)14-6-9-19-16-22(25-17-19)15-18-7-4-3-5-8-18/h3-5,7-8,10-13,16-17H,6,9,14-15H2,1-2H3
InChI Key:
YTQSLQXMYLYMBB-UHFFFAOYSA-N
SMILES:
Clc1ccc(cc1)C(CCCc1coc(c1)Cc1ccccc1)(C)C
Properties
Complexity:
380
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
352.159g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
352.902g/mol
Monoisotopic Mass:
352.159g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
13.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7.7
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