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114476-30-1

114476-30-1 | 1H-Pyrido[2,3-c]carbazole-2-carboxylic acid, 4,7-dihydro-1-oxo-, ethyl ester

CAS No: 114476-30-1 Catalog No: AG000EHB MDL No:

Product Description

Catalog Number:
AG000EHB
Chemical Name:
1H-Pyrido[2,3-c]carbazole-2-carboxylic acid, 4,7-dihydro-1-oxo-, ethyl ester
CAS Number:
114476-30-1
Molecular Formula:
C18H14N2O3
Molecular Weight:
306.3154
IUPAC Name:
ethyl 1-oxo-4,7-dihydropyrido[2,3-c]carbazole-2-carboxylate
InChI:
InChI=1S/C18H14N2O3/c1-2-23-18(22)11-9-19-13-7-8-14-15(16(13)17(11)21)10-5-3-4-6-12(10)20-14/h3-9,20H,2H2,1H3,(H,19,21)
InChI Key:
DGDBHQJHMRKOKH-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1c[nH]c2c(c1=O)c1c(cc2)[nH]c2c1cccc2

Properties

Complexity:
544  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
306.1g/mol
Formal Charge:
0
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
306.321g/mol
Monoisotopic Mass:
306.1g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
71.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5  

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