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89229-15-2 | 2-Propenoic acid, 3-(2,7-dimethoxy-1-naphthalenyl)-, methyl ester
CAS No: 89229-15-2 Catalog No: AG0043E0 MDL No:
Product Description
Catalog Number:
AG0043E0
Chemical Name:
2-Propenoic acid, 3-(2,7-dimethoxy-1-naphthalenyl)-, methyl ester
CAS Number:
89229-15-2
Molecular Formula:
C16H16O4
Molecular Weight:
272.2958
IUPAC Name:
methyl 3-(2,7-dimethoxynaphthalen-1-yl)prop-2-enoate
InChI:
InChI=1S/C16H16O4/c1-18-12-6-4-11-5-8-15(19-2)13(14(11)10-12)7-9-16(17)20-3/h4-10H,1-3H3
InChI Key:
BCSQAFWKLCGIPV-UHFFFAOYSA-N
SMILES:
COC(=O)C=Cc1c(OC)ccc2c1cc(OC)cc2
Properties
Complexity:
352
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
272.105g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
272.3g/mol
Monoisotopic Mass:
272.105g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
44.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
3.4
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