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Home > Bromides > 1000343-72-5
1000343-72-5 | 1H-Indole, 4-broMo-6-(1-Methylethyl)-
CAS No: 1000343-72-5 Catalog No: AG0000LA MDL No:
Product Description
Catalog Number:
AG0000LA
Chemical Name:
1H-Indole, 4-broMo-6-(1-Methylethyl)-
CAS Number:
1000343-72-5
Molecular Formula:
C11H12BrN
Molecular Weight:
238.1237
IUPAC Name:
4-bromo-6-propan-2-yl-1H-indole
InChI:
InChI=1S/C11H12BrN/c1-7(2)8-5-10(12)9-3-4-13-11(9)6-8/h3-7,13H,1-2H3
InChI Key:
LGQLORJHFRJVBT-UHFFFAOYSA-N
SMILES:
CC(c1cc(Br)c2c(c1)[nH]cc2)C
Properties
Complexity:
181
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
237.015g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
238.128g/mol
Monoisotopic Mass:
237.015g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
15.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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