Home Halogens methyl 3-amino-6-chloro-2-fluorobenzoate

methyl 3-amino-6-chloro-2-fluorobenzoate

CAS No.:
1782596-20-6
Catalog Number:
AG01C078
Molecular Formula:
C8H7ClFNO2
Molecular Weight:
203.5981
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Product Description
Catalog Number:
AG01C078
Chemical Name:
methyl 3-amino-6-chloro-2-fluorobenzoate
CAS Number:
1782596-20-6
Molecular Formula:
C8H7ClFNO2
Molecular Weight:
203.5981
MDL Number:
MFCD28650869
IUPAC Name:
methyl 3-amino-6-chloro-2-fluorobenzoate
InChI:
InChI=1S/C8H7ClFNO2/c1-13-8(12)6-4(9)2-3-5(11)7(6)10/h2-3H,11H2,1H3
InChI Key:
KTOYABBZOAPFBS-UHFFFAOYSA-N
SMILES:
COC(=O)c1c(Cl)ccc(c1F)N
Properties
Complexity:
203  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
203.015g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
203.597g/mol
Monoisotopic Mass:
203.015g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
52.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties