Home Carboxys Ethyl 9H-xanthene-9-carboxylate

Ethyl 9H-xanthene-9-carboxylate

CAS No.:
7401-03-8
Catalog Number:
AG003QHO
Molecular Formula:
C16H14O3
Molecular Weight:
254.2806
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Product Description
Catalog Number:
AG003QHO
Chemical Name:
Ethyl 9H-xanthene-9-carboxylate
CAS Number:
7401-03-8
Molecular Formula:
C16H14O3
Molecular Weight:
254.2806
MDL Number:
MFCD00100669
IUPAC Name:
ethyl 9H-xanthene-9-carboxylate
InChI:
InChI=1S/C16H14O3/c1-2-18-16(17)15-11-7-3-5-9-13(11)19-14-10-6-4-8-12(14)15/h3-10,15H,2H2,1H3
InChI Key:
LFHPCJSHNRJCEY-UHFFFAOYSA-N
SMILES:
CCOC(=O)C1c2ccccc2Oc2c1cccc2
NSC Number:
37339
Properties
Complexity:
306  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
254.094g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
254.285g/mol
Monoisotopic Mass:
254.094g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties