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Home > Indoles and Oxindole > 88253-66-1
88253-66-1 | 1H-Indole, 2,3-dihydro-3,3-dimethyl-2-methylene-1-pentyl-
CAS No: 88253-66-1 Catalog No: AG004CGY MDL No:
Product Description
Catalog Number:
AG004CGY
Chemical Name:
1H-Indole, 2,3-dihydro-3,3-dimethyl-2-methylene-1-pentyl-
CAS Number:
88253-66-1
Molecular Formula:
C16H23N
Molecular Weight:
229.3605
IUPAC Name:
3,3-dimethyl-2-methylidene-1-pentylindole
InChI:
InChI=1S/C16H23N/c1-5-6-9-12-17-13(2)16(3,4)14-10-7-8-11-15(14)17/h7-8,10-11H,2,5-6,9,12H2,1,3-4H3
InChI Key:
GNHDFWAMLZAMAT-UHFFFAOYSA-N
SMILES:
CCCCCN1c2ccccc2C(C1=C)(C)C
Properties
Complexity:
279
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.183g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
229.367g/mol
Monoisotopic Mass:
229.183g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
3.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.2
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