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113929-40-1 | Naphthalene, 2-[3-(3,4-dimethoxyphenyl)-1-propen-1-yl]-
CAS No: 113929-40-1 Catalog No: AG000A30 MDL No:
Product Description
Catalog Number:
AG000A30
Chemical Name:
Naphthalene, 2-[3-(3,4-dimethoxyphenyl)-1-propen-1-yl]-
CAS Number:
113929-40-1
Molecular Formula:
C21H20O2
Molecular Weight:
304.3823
IUPAC Name:
2-[3-(3,4-dimethoxyphenyl)prop-1-enyl]naphthalene
InChI:
InChI=1S/C21H20O2/c1-22-20-13-11-17(15-21(20)23-2)7-5-6-16-10-12-18-8-3-4-9-19(18)14-16/h3-6,8-15H,7H2,1-2H3
InChI Key:
DMFBLPJVUBNQQX-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1OC)CC=Cc1ccc2c(c1)cccc2
Properties
Complexity:
378
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
304.146g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
304.389g/mol
Monoisotopic Mass:
304.146g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
5.7
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