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1260675-08-8

1260675-08-8 | 1H-Indole, 3-(2-bromoethyl)-5-methyl-

CAS No: 1260675-08-8 Catalog No: AG000R1Q MDL No:

Product Description

Catalog Number:
AG000R1Q
Chemical Name:
1H-Indole, 3-(2-bromoethyl)-5-methyl-
CAS Number:
1260675-08-8
Molecular Formula:
C11H12BrN
Molecular Weight:
238.1237
IUPAC Name:
3-(2-bromoethyl)-5-methyl-1H-indole
InChI:
InChI=1S/C11H12BrN/c1-8-2-3-11-10(6-8)9(4-5-12)7-13-11/h2-3,6-7,13H,4-5H2,1H3
InChI Key:
MRDJFDQVUHMPBU-UHFFFAOYSA-N
SMILES:
BrCCc1c[nH]c2c1cc(C)cc2

Properties

Complexity:
172  
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:
2  
Topological Polar Surface Area:
15.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  

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