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1149-42-4 | Propanoic acid,2-[[[(3-chlorophenyl)amino]carbonyl]oxy]-, ethyl ester
CAS No: 1149-42-4 Catalog No: AG000FFC MDL No:
Product Description
Catalog Number:
AG000FFC
Chemical Name:
Propanoic acid,2-[[[(3-chlorophenyl)amino]carbonyl]oxy]-, ethyl ester
CAS Number:
1149-42-4
Molecular Formula:
C12H14ClNO4
Molecular Weight:
271.6969
IUPAC Name:
ethyl 2-[(3-chlorophenyl)carbamoyloxy]propanoate
InChI:
InChI=1S/C12H14ClNO4/c1-3-17-11(15)8(2)18-12(16)14-10-6-4-5-9(13)7-10/h4-8H,3H2,1-2H3,(H,14,16)
InChI Key:
ZXUAHEYZOUGVLU-UHFFFAOYSA-N
SMILES:
CCOC(=O)C(OC(=O)Nc1cccc(c1)Cl)C
NSC Number:
29687
Properties
Complexity:
298
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
271.061g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
271.697g/mol
Monoisotopic Mass:
271.061g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
64.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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