Home Halogens methyl 2-amino-4-bromo-3-methylbenzoate

methyl 2-amino-4-bromo-3-methylbenzoate

CAS No.:
851045-38-0
Catalog Number:
AG019SRV
Molecular Formula:
C9H10BrNO2
Molecular Weight:
244.0852
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Product Description
Catalog Number:
AG019SRV
Chemical Name:
methyl 2-amino-4-bromo-3-methylbenzoate
CAS Number:
851045-38-0
Molecular Formula:
C9H10BrNO2
Molecular Weight:
244.0852
MDL Number:
MFCD17244231
IUPAC Name:
methyl 2-amino-4-bromo-3-methylbenzoate
InChI:
InChI=1S/C9H10BrNO2/c1-5-7(10)4-3-6(8(5)11)9(12)13-2/h3-4H,11H2,1-2H3
InChI Key:
FOCWGRWJOKQCAE-UHFFFAOYSA-N
SMILES:
COC(=O)c1ccc(c(c1N)C)Br
Properties
Complexity:
198  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.989g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
244.088g/mol
Monoisotopic Mass:
242.989g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
52.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Properties