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Home > Bromides > 1186663-45-5
1186663-45-5 | Methyl 3-bromo-1-methyl-1H-indole-6-carboxylate
CAS No: 1186663-45-5 Catalog No: AG003RRC MDL No:MFCD12828701
Product Description
Catalog Number:
AG003RRC
Chemical Name:
Methyl 3-bromo-1-methyl-1H-indole-6-carboxylate
CAS Number:
1186663-45-5
Molecular Formula:
C11H10BrNO2
Molecular Weight:
268.1066
MDL Number:
MFCD12828701
IUPAC Name:
methyl 3-bromo-1-methylindole-6-carboxylate
InChI:
InChI=1S/C11H10BrNO2/c1-13-6-9(12)8-4-3-7(5-10(8)13)11(14)15-2/h3-6H,1-2H3
InChI Key:
BNUJUFJNYWGDTC-UHFFFAOYSA-N
SMILES:
COC(=O)c1ccc2c(c1)n(C)cc2Br
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:
0
Isotope Atom Count:
0
Molecular Weight:
268.11g/mol
Monoisotopic Mass:
266.989g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
31.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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