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Home > Bromides > 1167055-78-8
1167055-78-8 | 1H-Indole, 6-bromo-4-methoxy-7-methyl-
CAS No: 1167055-78-8 Catalog No: AG000D1W MDL No:
Product Description
Catalog Number:
AG000D1W
Chemical Name:
1H-Indole, 6-bromo-4-methoxy-7-methyl-
CAS Number:
1167055-78-8
Molecular Formula:
C10H10BrNO
Molecular Weight:
240.0965
IUPAC Name:
6-bromo-4-methoxy-7-methyl-1H-indole
InChI:
InChI=1S/C10H10BrNO/c1-6-8(11)5-9(13-2)7-3-4-12-10(6)7/h3-5,12H,1-2H3
InChI Key:
RXFJQMXJLSJPPK-UHFFFAOYSA-N
SMILES:
COc1cc(Br)c(c2c1cc[nH]2)C
Properties
Complexity:
188
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.995g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
240.1g/mol
Monoisotopic Mass:
238.995g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
25A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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