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38160-52-0 | 3-(DODECYLTHIO)PROPIONALDEHYDE
CAS No: 38160-52-0 Catalog No: AG007BMU MDL No:
Product Description
Catalog Number:
AG007BMU
Chemical Name:
3-(DODECYLTHIO)PROPIONALDEHYDE
CAS Number:
38160-52-0
Molecular Formula:
C15H30OS
Molecular Weight:
258.4631
IUPAC Name:
3-dodecylsulfanylpropanal
InChI:
InChI=1S/C15H30OS/c1-2-3-4-5-6-7-8-9-10-11-14-17-15-12-13-16/h13H,2-12,14-15H2,1H3
InChI Key:
OZHOOMFSHZDMMS-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCSCCC=O
EC Number:
253-807-7
Properties
Complexity:
148
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
258.202g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
258.464g/mol
Monoisotopic Mass:
258.202g/mol
Rotatable Bond Count:
14
Topological Polar Surface Area:
42.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.9
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