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142207-17-8 | Benzoic acid, 4-[(dimethylamino)carbonyl]-, ethyl ester
CAS No: 142207-17-8 Catalog No: AG001HYZ MDL No:
Product Description
Catalog Number:
AG001HYZ
Chemical Name:
Benzoic acid, 4-[(dimethylamino)carbonyl]-, ethyl ester
CAS Number:
142207-17-8
Molecular Formula:
C12H15NO3
Molecular Weight:
221.2524
IUPAC Name:
ethyl 4-(dimethylcarbamoyl)benzoate
InChI:
InChI=1S/C12H15NO3/c1-4-16-12(15)10-7-5-9(6-8-10)11(14)13(2)3/h5-8H,4H2,1-3H3
InChI Key:
OJMPEVBWOQMLNX-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1ccc(cc1)C(=O)N(C)C
Properties
Complexity:
255
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.105g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
221.256g/mol
Monoisotopic Mass:
221.105g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
46.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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