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1314929-15-1

1314929-15-1 | Methyl 3-fluoro-2-methylbenzoylformate

CAS No: 1314929-15-1 Catalog No: AG01FCMF MDL No:

Product Description

Catalog Number:
AG01FCMF
Chemical Name:
Methyl 3-fluoro-2-methylbenzoylformate
CAS Number:
1314929-15-1
Molecular Formula:
C10H9FO3
Molecular Weight:
196.1751
IUPAC Name:
methyl 2-(3-fluoro-2-methylphenyl)-2-oxoacetate
InChI:
InChI=1S/C10H9FO3/c1-6-7(4-3-5-8(6)11)9(12)10(13)14-2/h3-5H,1-2H3
InChI Key:
ADTWWAJESRIOTI-UHFFFAOYSA-N
SMILES:
Cc1c(cccc1F)C(=O)C(=O)OC

Properties

Complexity:
240  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.054g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
196.177g/mol
Monoisotopic Mass:
196.054g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
43.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  

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