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16518-65-3 | 3-Dimethylaminobenzoic acid ethyl ester
CAS No: 16518-65-3 Catalog No: AG01FCG0 MDL No:
Product Description
Catalog Number:
AG01FCG0
Chemical Name:
3-Dimethylaminobenzoic acid ethyl ester
CAS Number:
16518-65-3
Molecular Formula:
C11H15NO2
Molecular Weight:
193.2423
IUPAC Name:
ethyl 3-(dimethylamino)benzoate
InChI:
InChI=1S/C11H15NO2/c1-4-14-11(13)9-6-5-7-10(8-9)12(2)3/h5-8H,4H2,1-3H3
InChI Key:
CQNOGTUXPYIVDM-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1cccc(c1)N(C)C
Properties
Complexity:
192
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.11g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
193.246g/mol
Monoisotopic Mass:
193.11g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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