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88036-81-1 | Benzaldehyde, 3,4-bis[(4-chlorophenyl)methoxy]-
CAS No: 88036-81-1 Catalog No: AG004J79 MDL No:
Product Description
Catalog Number:
AG004J79
Chemical Name:
Benzaldehyde, 3,4-bis[(4-chlorophenyl)methoxy]-
CAS Number:
88036-81-1
Molecular Formula:
C21H16Cl2O3
Molecular Weight:
387.2559
IUPAC Name:
3,4-bis[(4-chlorophenyl)methoxy]benzaldehyde
InChI:
InChI=1S/C21H16Cl2O3/c22-18-6-1-15(2-7-18)13-25-20-10-5-17(12-24)11-21(20)26-14-16-3-8-19(23)9-4-16/h1-12H,13-14H2
InChI Key:
HAUZFJGLZJQHOP-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(c(c1)OCc1ccc(cc1)Cl)OCc1ccc(cc1)Cl
Properties
Complexity:
418
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
386.048g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
387.256g/mol
Monoisotopic Mass:
386.048g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.6
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