Home Halogens ethyl 2-amino-3-bromo-5-methylbenzoate

ethyl 2-amino-3-bromo-5-methylbenzoate

CAS No.:
1171131-04-6
Catalog Number:
AG01AJGT
Molecular Formula:
C10H12BrNO2
Molecular Weight:
258.1118
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Product Description
Catalog Number:
AG01AJGT
Chemical Name:
ethyl 2-amino-3-bromo-5-methylbenzoate
CAS Number:
1171131-04-6
Molecular Formula:
C10H12BrNO2
Molecular Weight:
258.1118
MDL Number:
MFCD12159905
IUPAC Name:
ethyl 2-amino-3-bromo-5-methylbenzoate
InChI:
InChI=1S/C10H12BrNO2/c1-3-14-10(13)7-4-6(2)5-8(11)9(7)12/h4-5H,3,12H2,1-2H3
InChI Key:
JWLQBNSDENZEGI-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1cc(C)cc(c1N)Br
Properties
Complexity:
210  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
257.005g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
258.115g/mol
Monoisotopic Mass:
257.005g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
52.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  
Properties