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19013-44-6

19013-44-6 | 3H-Indole, 3-ethyl-3-methyl-

CAS No: 19013-44-6 Catalog No: AG002ECS MDL No:

Product Description

Catalog Number:
AG002ECS
Chemical Name:
3H-Indole, 3-ethyl-3-methyl-
CAS Number:
19013-44-6
Molecular Formula:
C11H13N
Molecular Weight:
159.2276
IUPAC Name:
3-ethyl-3-methylindole
InChI:
InChI=1S/C11H13N/c1-3-11(2)8-12-10-7-5-4-6-9(10)11/h4-8H,3H2,1-2H3
InChI Key:
NRDPPVARKSPYDK-UHFFFAOYSA-N
SMILES:
CCC1(C)C=Nc2c1cccc2

Properties

Complexity:
197  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
159.105g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
159.232g/mol
Monoisotopic Mass:
159.105g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
12.4A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  

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