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113918-65-3 | 2-Propenoic acid, 2-methyl-, 4-methoxy-1-naphthalenyl ester
CAS No: 113918-65-3 Catalog No: AG000A2B MDL No:
Product Description
Catalog Number:
AG000A2B
Chemical Name:
2-Propenoic acid, 2-methyl-, 4-methoxy-1-naphthalenyl ester
CAS Number:
113918-65-3
Molecular Formula:
C15H14O3
Molecular Weight:
242.2699
IUPAC Name:
(4-methoxynaphthalen-1-yl) 2-methylprop-2-enoate
InChI:
InChI=1S/C15H14O3/c1-10(2)15(16)18-14-9-8-13(17-3)11-6-4-5-7-12(11)14/h4-9H,1H2,2-3H3
InChI Key:
HNYQTPJMDTXLIT-UHFFFAOYSA-N
SMILES:
COc1ccc(c2c1cccc2)OC(=O)C(=C)C
Properties
Complexity:
324
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.094g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
242.274g/mol
Monoisotopic Mass:
242.094g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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