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24677-02-9 | Benzoic acid, 2-[(diethylamino)carbonyl]-, ethyl ester
CAS No: 24677-02-9 Catalog No: AG002P0D MDL No:
Product Description
Catalog Number:
AG002P0D
Chemical Name:
Benzoic acid, 2-[(diethylamino)carbonyl]-, ethyl ester
CAS Number:
24677-02-9
Molecular Formula:
C14H19NO3
Molecular Weight:
249.3056
IUPAC Name:
ethyl 2-(diethylcarbamoyl)benzoate
InChI:
InChI=1S/C14H19NO3/c1-4-15(5-2)13(16)11-9-7-8-10-12(11)14(17)18-6-3/h7-10H,4-6H2,1-3H3
InChI Key:
HJVVPRGNRXTJLA-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1ccccc1C(=O)N(CC)CC
Properties
Complexity:
287
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
249.136g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
249.31g/mol
Monoisotopic Mass:
249.136g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
46.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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