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128057-44-3 | 3-METHYLENE-HEPTADECANE
CAS No: 128057-44-3 Catalog No: AG000XQJ MDL No:
Product Description
Catalog Number:
AG000XQJ
Chemical Name:
3-METHYLENE-HEPTADECANE
CAS Number:
128057-44-3
Molecular Formula:
C18H36
Molecular Weight:
252.4784
IUPAC Name:
3-methylideneheptadecane
InChI:
InChI=1S/C18H36/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18(3)5-2/h3-17H2,1-2H3
InChI Key:
LCFDRPQKZJDBHH-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCCCC(=C)CC
EC Number:
603-253-0
Properties
Complexity:
169
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:
14
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
9.4
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