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289032-37-7 | [1,1'-Biphenyl]-4-pentanal
CAS No: 289032-37-7 Catalog No: AG002X0J MDL No:
Product Description
Catalog Number:
AG002X0J
Chemical Name:
[1,1'-Biphenyl]-4-pentanal
CAS Number:
289032-37-7
Molecular Formula:
C17H18O
Molecular Weight:
238.3242
IUPAC Name:
5-(4-phenylphenyl)pentanal
InChI:
InChI=1S/C17H18O/c18-14-6-2-3-7-15-10-12-17(13-11-15)16-8-4-1-5-9-16/h1,4-5,8-14H,2-3,6-7H2
InChI Key:
HNGZRZPLJYYCFY-UHFFFAOYSA-N
SMILES:
O=CCCCCc1ccc(cc1)c1ccccc1
Properties
Complexity:
222
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.136g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
238.33g/mol
Monoisotopic Mass:
238.136g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
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