1-(prop-2-en-1-yl)naphthalene
Product Information
Molecular Formula
C13H12
Molecular Weight
168.2344
Description
1-(prop-2-en-1-yl)naphthalene is a chemical entity instrumental in biomedical investigations. It finds application in exploring potential therapeutic agents targeting a myriad of cardiovascular pathologies and specific oncological types.
Synonyms
1-ALLYLNAPHTHALENE; 2489-86-3; 3-(1-Naphthyl)-1-propene; Naphthalene, 1-allyl-; 1-prop-2-enylnaphthalene; Naphthalene, 1-(2-propenyl)-; 1-(2-Propenyl)naphthalene; 1-(prop-2-en-1-yl)naphthalene; Naphthalene, (2-propenyl)-; MFCD00021581; alpha-Allylnaphthalene; BRN 1927776; 1-(2-propenyl)-naphthalene; 1-(2-propen-1-yl)-Naphthalene; .alpha.-Allylnaphthalene; 3-05-00-01805 (Beilstein Handbook Reference); DTXSID00179588; ZINC2036107; Naphthalene, 1-(2-propen-1-yl)-; 3-(1-Naphthyl)-1-propene, 99%; AKOS006344680; AC-4946; CS-W014297; SB66829; DS-18514; DB-027358; FT-0634320; A18524; EN300-698376; F14947; 489A863; J-504173;
IUPAC Name
1-prop-2-enylnaphthalene
SMILES
C=CCC1=CC=CC2=CC=CC=C21
InChI
InChI=1S/C13H12/c1-2-6-11-8-5-9-12-7-3-4-10-13(11)12/h2-5,7-10H,1,6H2
InChI Key
RJFCFNWLPJRCLR-UHFFFAOYSA-N
Boiling Point
170 °C / 14 mmHg
Flash Point
119.5 °C
Purity
>95.0%(GC)
Density
1.001 g/mL
Appearance
Light orange to Yellow to Green clear liquid
Storage
Sealed in dry. Room temperature.
Refractive Index
1.606
Safety Information
Hazards
H413
Precautionary Statement
P501 P273
Signal Word
Warning
Computed Properties
XLogP3
4.7
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
0
Rotatable Bond Count
2
Exact Mass
168.093900383 g/mol
Monoisotopic Mass
168.093900383 g/mol
Topological Polar Surface Area
0Ų
Heavy Atom Count
13
Formal Charge
0
Complexity
171
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
1
Compound Is Canonicalized
Yes
