Home Halogens methyl 5-amino-2-chloro-3-fluorobenzoate

methyl 5-amino-2-chloro-3-fluorobenzoate

CAS No.:
1256260-38-4
Catalog Number:
AG01BB5A
Molecular Formula:
C8H7ClFNO2
Molecular Weight:
203.5981
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Product Description
Catalog Number:
AG01BB5A
Chemical Name:
methyl 5-amino-2-chloro-3-fluorobenzoate
CAS Number:
1256260-38-4
Molecular Formula:
C8H7ClFNO2
Molecular Weight:
203.5981
MDL Number:
MFCD24111339
IUPAC Name:
methyl 5-amino-2-chloro-3-fluorobenzoate
InChI:
InChI=1S/C8H7ClFNO2/c1-13-8(12)5-2-4(11)3-6(10)7(5)9/h2-3H,11H2,1H3
InChI Key:
XVTARICOQIMAEM-UHFFFAOYSA-N
SMILES:
COC(=O)c1cc(N)cc(c1Cl)F
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:
1.8  
Properties