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139650-36-5 | Pentane, 1-[(1-methyl-2-propen-1-yl)oxy]-
CAS No: 139650-36-5 Catalog No: AG001BGJ MDL No:
Product Description
Catalog Number:
AG001BGJ
Chemical Name:
Pentane, 1-[(1-methyl-2-propen-1-yl)oxy]-
CAS Number:
139650-36-5
Molecular Formula:
C9H18O
Molecular Weight:
142.2386
IUPAC Name:
1-but-3-en-2-yloxypentane
InChI:
InChI=1S/C9H18O/c1-4-6-7-8-10-9(3)5-2/h5,9H,2,4,6-8H2,1,3H3
InChI Key:
DZIPXLPDJVYIHO-UHFFFAOYSA-N
SMILES:
CC(C=C)OCCCCC
Properties
Complexity:
78.8
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
142.136g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
142.242g/mol
Monoisotopic Mass:
142.136g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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