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114608-54-7

114608-54-7 | 11H-Benzo[a]carbazole-3-carboxylic acid, 2-hydroxy-8-methyl-

CAS No: 114608-54-7 Catalog No: AG000ETB MDL No:

Product Description

Catalog Number:
AG000ETB
Chemical Name:
11H-Benzo[a]carbazole-3-carboxylic acid, 2-hydroxy-8-methyl-
CAS Number:
114608-54-7
Molecular Formula:
C18H13NO3
Molecular Weight:
291.3007
IUPAC Name:
2-hydroxy-8-methyl-11H-benzo[a]carbazole-3-carboxylic acid
InChI:
InChI=1S/C18H13NO3/c1-9-2-5-15-13(6-9)11-4-3-10-7-14(18(21)22)16(20)8-12(10)17(11)19-15/h2-8,19-20H,1H3,(H,21,22)
InChI Key:
KSUSJKKZKZMRNN-UHFFFAOYSA-N
SMILES:
Cc1ccc2c(c1)c1ccc3c(c1[nH]2)cc(c(c3)C(=O)O)O

Properties

Complexity:
454  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
291.09g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
291.306g/mol
Monoisotopic Mass:
291.09g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
73.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7  

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