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DIMETHYL 1,4-NAPHTHALENEDICARBOXYLATE

CAS No.:
7487-15-2
Catalog Number:
AG0058TK
Molecular Formula:
C14H12O4
Molecular Weight:
244.2427
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Product Description
Catalog Number:
AG0058TK
Chemical Name:
DIMETHYL 1,4-NAPHTHALENEDICARBOXYLATE
CAS Number:
7487-15-2
Molecular Formula:
C14H12O4
Molecular Weight:
244.2427
MDL Number:
MFCD04038075
IUPAC Name:
dimethyl naphthalene-1,4-dicarboxylate
InChI:
InChI=1S/C14H12O4/c1-17-13(15)11-7-8-12(14(16)18-2)10-6-4-3-5-9(10)11/h3-8H,1-2H3
InChI Key:
OCSXMIBZIHMVCP-UHFFFAOYSA-N
SMILES:
COC(=O)c1ccc(c2c1cccc2)C(=O)OC
Properties
Complexity:
294  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
244.074g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
244.246g/mol
Monoisotopic Mass:
244.074g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties