Home Halogens methyl 2-bromo-3-methyl-1H-indole-5-carboxylate

methyl 2-bromo-3-methyl-1H-indole-5-carboxylate

CAS No.:
1803587-93-0
Catalog Number:
AG01BBXI
Molecular Formula:
C11H10BrNO2
Molecular Weight:
268.1066
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Product Description
Catalog Number:
AG01BBXI
Chemical Name:
methyl 2-bromo-3-methyl-1H-indole-5-carboxylate
CAS Number:
1803587-93-0
Molecular Formula:
C11H10BrNO2
Molecular Weight:
268.1066
MDL Number:
MFCD23159819
IUPAC Name:
methyl 2-bromo-3-methyl-1H-indole-5-carboxylate
InChI:
InChI=1S/C11H10BrNO2/c1-6-8-5-7(11(14)15-2)3-4-9(8)13-10(6)12/h3-5,13H,1-2H3
InChI Key:
VCVDCWPJSRKSJR-UHFFFAOYSA-N
SMILES:
COC(=O)c1ccc2c(c1)c(C)c([nH]2)Br
Properties
Complexity:
259  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
266.989g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
268.11g/mol
Monoisotopic Mass:
266.989g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
42.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  
Properties