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1373519-61-9

1373519-61-9 | Ethyl 4-chloro-3-ethylbenzoylformate

CAS No: 1373519-61-9 Catalog No: AG01FDIV MDL No:

Product Description

Catalog Number:
AG01FDIV
Chemical Name:
Ethyl 4-chloro-3-ethylbenzoylformate
CAS Number:
1373519-61-9
Molecular Formula:
C12H13ClO3
Molecular Weight:
240.6828
IUPAC Name:
ethyl 2-(4-chloro-3-ethylphenyl)-2-oxoacetate
InChI:
InChI=1S/C12H13ClO3/c1-3-8-7-9(5-6-10(8)13)11(14)12(15)16-4-2/h5-7H,3-4H2,1-2H3
InChI Key:
STPGNGSDZLEHAQ-UHFFFAOYSA-N
SMILES:
CCOC(=O)C(=O)c1ccc(c(c1)CC)Cl

Properties

Complexity:
265  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
240.055g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
240.683g/mol
Monoisotopic Mass:
240.055g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
43.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4  

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