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131780-17-1 | 4-Penten-1-one, 1-(2-naphthalenyl)-
CAS No: 131780-17-1 Catalog No: AG000ZQ6 MDL No:
Product Description
Catalog Number:
AG000ZQ6
Chemical Name:
4-Penten-1-one, 1-(2-naphthalenyl)-
CAS Number:
131780-17-1
Molecular Formula:
C15H14O
Molecular Weight:
210.2711
IUPAC Name:
1-naphthalen-2-ylpent-4-en-1-one
InChI:
InChI=1S/C15H14O/c1-2-3-8-15(16)14-10-9-12-6-4-5-7-13(12)11-14/h2,4-7,9-11H,1,3,8H2
InChI Key:
WIAUUUGTXIPCSX-UHFFFAOYSA-N
SMILES:
C=CCCC(=O)c1ccc2c(c1)cccc2
Properties
Complexity:
256
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.104g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
210.276g/mol
Monoisotopic Mass:
210.104g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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