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Home > Indoles and Oxindole > 141619-82-1
141619-82-1 | 1H-Indole, 1-hexadecyl-2,3-dihydro-3,3,5-trimethyl-2-methylene-
CAS No: 141619-82-1 Catalog No: AG001GP4 MDL No:
Product Description
Catalog Number:
AG001GP4
Chemical Name:
1H-Indole, 1-hexadecyl-2,3-dihydro-3,3,5-trimethyl-2-methylene-
CAS Number:
141619-82-1
Molecular Formula:
C28H47N
Molecular Weight:
397.6795
IUPAC Name:
1-hexadecyl-3,3,5-trimethyl-2-methylideneindole
InChI:
InChI=1S/C28H47N/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22-29-25(3)28(4,5)26-23-24(2)20-21-27(26)29/h20-21,23H,3,6-19,22H2,1-2,4-5H3
InChI Key:
DRMJNCHAHPNBFF-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCCCCCN1c2ccc(cc2C(C1=C)(C)C)C
Properties
Complexity:
451
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
397.371g/mol
Formal Charge:
0
Heavy Atom Count:
29
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
397.691g/mol
Monoisotopic Mass:
397.371g/mol
Rotatable Bond Count:
15
Topological Polar Surface Area:
3.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
11.5
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