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162100-44-9 | 1H-Indole, 6-chloro-2,3-dihydro-5-methyl-
CAS No: 162100-44-9 Catalog No: AG001SQY MDL No:
Product Description
Catalog Number:
AG001SQY
Chemical Name:
1H-Indole, 6-chloro-2,3-dihydro-5-methyl-
CAS Number:
162100-44-9
Molecular Formula:
C9H10ClN
Molecular Weight:
167.6354
IUPAC Name:
6-chloro-5-methyl-2,3-dihydro-1H-indole
InChI:
InChI=1S/C9H10ClN/c1-6-4-7-2-3-11-9(7)5-8(6)10/h4-5,11H,2-3H2,1H3
InChI Key:
ZAMJLADJGLXVOJ-UHFFFAOYSA-N
SMILES:
Clc1cc2NCCc2cc1C
Properties
Complexity:
149
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
167.05g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
167.636g/mol
Monoisotopic Mass:
167.05g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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