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1321-89-7 | Isodecanal
CAS No: 1321-89-7 Catalog No: AG00108K MDL No:
Product Description
Catalog Number:
AG00108K
Chemical Name:
Isodecanal
CAS Number:
1321-89-7
Molecular Formula:
C10H20O
Molecular Weight:
156.2652
IUPAC Name:
8-methylnonanal
InChI:
InChI=1S/C10H20O/c1-10(2)8-6-4-3-5-7-9-11/h9-10H,3-8H2,1-2H3
InChI Key:
WDMOXLRWVGEXJV-UHFFFAOYSA-N
SMILES:
O=CCCCCCCC(C)C
EC Number:
215-328-1
UNII:
CA4031G8P7
FEMA Number:
4803
Properties
Complexity:
86.9
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:
3.5
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