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137692-43-4 | Benzaldehyde, 2-hydroxynonyl-
CAS No: 137692-43-4 Catalog No: AG0013QK MDL No:
Product Description
Catalog Number:
AG0013QK
Chemical Name:
Benzaldehyde, 2-hydroxynonyl-
CAS Number:
137692-43-4
Molecular Formula:
C16H24O2
Molecular Weight:
248.3606
IUPAC Name:
2-(2-hydroxynonyl)benzaldehyde
InChI:
InChI=1S/C16H24O2/c1-2-3-4-5-6-11-16(18)12-14-9-7-8-10-15(14)13-17/h7-10,13,16,18H,2-6,11-12H2,1H3
InChI Key:
JJRWDMWYADAVRE-UHFFFAOYSA-N
SMILES:
CCCCCCCC(Cc1ccccc1C=O)O
Properties
Complexity:
215
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
248.178g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
248.366g/mol
Monoisotopic Mass:
248.178g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4
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