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Home > Aldehydes > 817622-90-5
817622-90-5 | 9H-Fluorene-2-carboxaldehyde, 7-iodo-9,9-dioctyl-
CAS No: 817622-90-5 Catalog No: AG00574I MDL No:
Product Description
Catalog Number:
AG00574I
Chemical Name:
9H-Fluorene-2-carboxaldehyde, 7-iodo-9,9-dioctyl-
CAS Number:
817622-90-5
Molecular Formula:
C30H41IO
Molecular Weight:
544.5504
IUPAC Name:
7-iodo-9,9-dioctylfluorene-2-carbaldehyde
InChI:
InChI=1S/C30H41IO/c1-3-5-7-9-11-13-19-30(20-14-12-10-8-6-4-2)28-21-24(23-32)15-17-26(28)27-18-16-25(31)22-29(27)30/h15-18,21-23H,3-14,19-20H2,1-2H3
InChI Key:
WQSPMJLQVBBULY-UHFFFAOYSA-N
SMILES:
CCCCCCCCC1(CCCCCCCC)c2cc(I)ccc2c2c1cc(C=O)cc2
Properties
Complexity:
515
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
544.22g/mol
Formal Charge:
0
Heavy Atom Count:
32
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
544.561g/mol
Monoisotopic Mass:
544.22g/mol
Rotatable Bond Count:
15
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
12.1
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