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17754-66-4 | Benzoyl chloride, 4,4'-[1,4-butanediylbis(oxy)]bis-
CAS No: 17754-66-4 Catalog No: AG0025DF MDL No:
Product Description
Catalog Number:
AG0025DF
Chemical Name:
Benzoyl chloride, 4,4'-[1,4-butanediylbis(oxy)]bis-
CAS Number:
17754-66-4
Molecular Formula:
C18H16Cl2O4
Molecular Weight:
367.2232
IUPAC Name:
4-[4-(4-carbonochloridoylphenoxy)butoxy]benzoyl chloride
InChI:
InChI=1S/C18H16Cl2O4/c19-17(21)13-3-7-15(8-4-13)23-11-1-2-12-24-16-9-5-14(6-10-16)18(20)22/h3-10H,1-2,11-12H2
InChI Key:
XTJSSCZTUIOIPD-UHFFFAOYSA-N
SMILES:
ClC(=O)c1ccc(cc1)OCCCCOc1ccc(cc1)C(=O)Cl
Properties
Complexity:
362
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
366.043g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
367.222g/mol
Monoisotopic Mass:
366.043g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.3
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