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Home > Indoles and Oxindole > 139037-98-2
139037-98-2 | 1H-Indole, 1-hexyl-2,3-dihydro-3,3,5-trimethyl-2-methylene-
CAS No: 139037-98-2 Catalog No: AG001A1Z MDL No:
Product Description
Catalog Number:
AG001A1Z
Chemical Name:
1H-Indole, 1-hexyl-2,3-dihydro-3,3,5-trimethyl-2-methylene-
CAS Number:
139037-98-2
Molecular Formula:
C18H27N
Molecular Weight:
257.4137
IUPAC Name:
1-hexyl-3,3,5-trimethyl-2-methylideneindole
InChI:
InChI=1S/C18H27N/c1-6-7-8-9-12-19-15(3)18(4,5)16-13-14(2)10-11-17(16)19/h10-11,13H,3,6-9,12H2,1-2,4-5H3
InChI Key:
IYHOEWZUCSRBAP-UHFFFAOYSA-N
SMILES:
CCCCCCN1c2ccc(cc2C(C1=C)(C)C)C
Properties
Complexity:
318
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
257.214g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
257.421g/mol
Monoisotopic Mass:
257.214g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
3.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.1
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