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115704-83-1

115704-83-1 | 1H,5H-Benzo[ij]quinolizin-8-ol, 2,3,6,7-tetrahydro-1,1,7,7-tetramethyl-

CAS No: 115704-83-1 Catalog No: AG000GRX MDL No:MFCD09264711

Product Description

Catalog Number:
AG000GRX
Chemical Name:
1H,5H-Benzo[ij]quinolizin-8-ol, 2,3,6,7-tetrahydro-1,1,7,7-tetramethyl-
CAS Number:
115704-83-1
Molecular Formula:
C16H23NO
Molecular Weight:
245.3599
MDL Number:
MFCD09264711
IUPAC Name:
4,4,10,10-tetramethyl-1-azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-trien-6-ol
InChI:
InChI=1S/C16H23NO/c1-15(2)7-9-17-10-8-16(3,4)13-12(18)6-5-11(15)14(13)17/h5-6,18H,7-10H2,1-4H3
InChI Key:
RBFKOHMQYNQBAR-UHFFFAOYSA-N
SMILES:
Oc1ccc2c3c1C(C)(C)CCN3CCC2(C)C

Properties

Complexity:
336  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
245.178g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
245.366g/mol
Monoisotopic Mass:
245.178g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
23.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2  

Literature

Title Journal
Synthesis of 5- and 6-carboxy-X-rhodamines. Organic letters 20081106

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