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1260770-73-7 | 1H-Indole, 3-(2-chloroethyl)-7-methyl-
CAS No: 1260770-73-7 Catalog No: AG000R6D MDL No:
Product Description
Catalog Number:
AG000R6D
Chemical Name:
1H-Indole, 3-(2-chloroethyl)-7-methyl-
CAS Number:
1260770-73-7
Molecular Formula:
C11H12ClN
Molecular Weight:
193.6727
IUPAC Name:
3-(2-chloroethyl)-7-methyl-1H-indole
InChI:
InChI=1S/C11H12ClN/c1-8-3-2-4-10-9(5-6-12)7-13-11(8)10/h2-4,7,13H,5-6H2,1H3
InChI Key:
KLAHCHFACLCTDN-UHFFFAOYSA-N
SMILES:
Cc1cccc2c1[nH]cc2CCCl
Properties
Complexity:
172
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.066g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
193.674g/mol
Monoisotopic Mass:
193.066g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
15.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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