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Home > Indoles and Oxindole > 73618-54-9
73618-54-9 | 1H-Indole, 3,6-bis(3-methyl-2-butenyl)-
CAS No: 73618-54-9 Catalog No: AG005C4V MDL No:
Product Description
Catalog Number:
AG005C4V
Chemical Name:
1H-Indole, 3,6-bis(3-methyl-2-butenyl)-
CAS Number:
73618-54-9
Molecular Formula:
C18H23N
Molecular Weight:
253.3819
IUPAC Name:
3,6-bis(3-methylbut-2-enyl)-1H-indole
InChI:
InChI=1S/C18H23N/c1-13(2)5-7-15-8-10-17-16(9-6-14(3)4)12-19-18(17)11-15/h5-6,8,10-12,19H,7,9H2,1-4H3
InChI Key:
NTGWNARXEPOAPV-UHFFFAOYSA-N
SMILES:
CC(=CCc1ccc2c(c1)[nH]cc2CC=C(C)C)C
Properties
Complexity:
345
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
253.183g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
253.389g/mol
Monoisotopic Mass:
253.183g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
15.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.9
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