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Home Carboxys 5-((1H-Indol-1-yl)methyl)furan-2-carboxylic acid

5-((1H-Indol-1-yl)methyl)furan-2-carboxylic acid

CAS No.:
876881-48-0
Catalog Number:
AG004NSL
Molecular Formula:
C14H11NO3
Molecular Weight:
241.2420
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$168
- +
5g
95%
In Stock USA
United States
$444
- +
Product Description
Catalog Number:
AG004NSL
Chemical Name:
5-((1H-Indol-1-yl)methyl)furan-2-carboxylic acid
CAS Number:
876881-48-0
Molecular Formula:
C14H11NO3
Molecular Weight:
241.2420
MDL Number:
MFCD06752042
IUPAC Name:
5-(indol-1-ylmethyl)furan-2-carboxylic acid
InChI:
InChI=1S/C14H11NO3/c16-14(17)13-6-5-11(18-13)9-15-8-7-10-3-1-2-4-12(10)15/h1-8H,9H2,(H,16,17)
InChI Key:
KXUPBSSWCTZYAC-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc(o1)Cn1ccc2c1cccc2
Properties
Complexity:
320  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
241.074g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
241.246g/mol
Monoisotopic Mass:
241.074g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
55.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Literature
Title Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
Properties