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13077-71-9 | 1,2-Propadiene, 1-ethoxy-
CAS No: 13077-71-9 Catalog No: AG000UXN MDL No:
Product Description
Catalog Number:
AG000UXN
Chemical Name:
1,2-Propadiene, 1-ethoxy-
CAS Number:
13077-71-9
Molecular Formula:
C5H8O
Molecular Weight:
84.1164
IUPAC Name:
1-ethoxypropa-1,2-diene
InChI:
InChI=1S/C5H8O/c1-3-5-6-4-2/h5H,1,4H2,2H3
InChI Key:
RXQCANOBVRBBOC-UHFFFAOYSA-N
SMILES:
CCOC=C=C
Properties
Complexity:
60.3
Compound Is Canonicalized:
No
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
84.058g/mol
Formal Charge:
0
Heavy Atom Count:
6
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
84.118g/mol
Monoisotopic Mass:
84.058g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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