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95081-73-5 | 1H-Indole, 2,3-dihydro-1,3,3-trimethyl-2-methylene-5-(2-phenylethenyl)-
CAS No: 95081-73-5 Catalog No: AG006PU4 MDL No:
Product Description
Catalog Number:
AG006PU4
Chemical Name:
1H-Indole, 2,3-dihydro-1,3,3-trimethyl-2-methylene-5-(2-phenylethenyl)-
CAS Number:
95081-73-5
Molecular Formula:
C20H21N
Molecular Weight:
275.3874
IUPAC Name:
1,3,3-trimethyl-2-methylidene-5-(2-phenylethenyl)indole
InChI:
InChI=1S/C20H21N/c1-15-20(2,3)18-14-17(12-13-19(18)21(15)4)11-10-16-8-6-5-7-9-16/h5-14H,1H2,2-4H3
InChI Key:
HKPUYTLVHBNRRT-UHFFFAOYSA-N
SMILES:
C=C1N(C)c2c(C1(C)C)cc(cc2)C=Cc1ccccc1
Properties
Complexity:
414
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
275.167g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
275.395g/mol
Monoisotopic Mass:
275.167g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
3.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
5.7
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