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1574-41-0 | 1,3-Pentadiene, (3Z)-
CAS No: 1574-41-0 Catalog No: AG001PFY MDL No:MFCD00063977
Product Description
Catalog Number:
AG001PFY
Chemical Name:
1,3-Pentadiene, (3Z)-
CAS Number:
1574-41-0
Molecular Formula:
C5H8
Molecular Weight:
68.1170
MDL Number:
MFCD00063977
IUPAC Name:
(3Z)-penta-1,3-diene
InChI:
InChI=1S/C5H8/c1-3-5-4-2/h3-5H,1H2,2H3/b5-4-
InChI Key:
PMJHHCWVYXUKFD-PLNGDYQASA-N
SMILES:
C/C=C\C=C
EC Number:
216-401-0
UNII:
PT6373J6YO
Properties
Complexity:
42
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
68.063g/mol
Formal Charge:
0
Heavy Atom Count:
5
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
68.119g/mol
Monoisotopic Mass:
68.063g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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