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122833-07-2 | Tridecane, 7-butyl-5-methylene-
CAS No: 122833-07-2 Catalog No: AG000JKG MDL No:
Product Description
Catalog Number:
AG000JKG
Chemical Name:
Tridecane, 7-butyl-5-methylene-
CAS Number:
122833-07-2
Molecular Formula:
C18H36
Molecular Weight:
252.4784
IUPAC Name:
7-butyl-5-methylidenetridecane
InChI:
InChI=1S/C18H36/c1-5-8-11-12-15-18(14-10-7-3)16-17(4)13-9-6-2/h18H,4-16H2,1-3H3
InChI Key:
CUTCIBVXOXUSGT-UHFFFAOYSA-N
SMILES:
CCCCCCC(CC(=C)CCCC)CCCC
Properties
Complexity:
181
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
252.282g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
252.486g/mol
Monoisotopic Mass:
252.282g/mol
Rotatable Bond Count:
13
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
9.1
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