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1471-03-0 | 1-Propene, 3-propoxy-
CAS No: 1471-03-0 Catalog No: AG001ELQ MDL No:
Product Description
Catalog Number:
AG001ELQ
Chemical Name:
1-Propene, 3-propoxy-
CAS Number:
1471-03-0
Molecular Formula:
C6H12O
Molecular Weight:
100.1589
IUPAC Name:
1-prop-2-enoxypropane
InChI:
InChI=1S/C6H12O/c1-3-5-7-6-4-2/h3H,1,4-6H2,2H3
InChI Key:
LWJHSQQHGRQCKO-UHFFFAOYSA-N
SMILES:
CCCOCC=C
NSC Number:
158160
Properties
Complexity:
41.4
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:
4
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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