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14092-18-3 | 1-Pentene, 3-methoxy-
CAS No: 14092-18-3 Catalog No: AG001FNB MDL No:
Product Description
Catalog Number:
AG001FNB
Chemical Name:
1-Pentene, 3-methoxy-
CAS Number:
14092-18-3
Molecular Formula:
C6H12O
Molecular Weight:
100.1589
IUPAC Name:
3-methoxypent-1-ene
InChI:
InChI=1S/C6H12O/c1-4-6(5-2)7-3/h4,6H,1,5H2,2-3H3
InChI Key:
QCKUVLJIMYEIRI-UHFFFAOYSA-N
SMILES:
CCC(C=C)OC
Properties
Complexity:
50.1
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
100.089g/mol
Formal Charge:
0
Heavy Atom Count:
7
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
100.161g/mol
Monoisotopic Mass:
100.089g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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