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18459-51-3 | Di-n-butylacetaldehyde
CAS No: 18459-51-3 Catalog No: AG003PNV MDL No:
Product Description
Catalog Number:
AG003PNV
Chemical Name:
Di-n-butylacetaldehyde
CAS Number:
18459-51-3
IUPAC Name:
2-butylhexanal
InChI:
InChI=1S/C10H20O/c1-3-5-7-10(9-11)8-6-4-2/h9-10H,3-8H2,1-2H3
InChI Key:
RACNVJFSQSOKGQ-UHFFFAOYSA-N
Properties
Complexity:
80.9
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
156.151g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
156.269g/mol
Monoisotopic Mass:
156.151g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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