Home Other Building Blocks 5-[(7-Hydroxy-2-Oxo-2H-Chromene-3-Carbonyl)-Amino]-Pentanoic Acid

5-[(7-Hydroxy-2-Oxo-2H-Chromene-3-Carbonyl)-Amino]-Pentanoic Acid

CAS No.:
1267539-46-7
Catalog Number:
AG01DJJ6
Molecular Formula:
C15H15NO6
Molecular Weight:
305.2827
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Product Description
Catalog Number:
AG01DJJ6
Chemical Name:
5-[(7-Hydroxy-2-Oxo-2H-Chromene-3-Carbonyl)-Amino]-Pentanoic Acid
CAS Number:
1267539-46-7
Molecular Formula:
C15H15NO6
Molecular Weight:
305.2827
MDL Number:
MFCD30185150
IUPAC Name:
5-[(7-hydroxy-2-oxochromene-3-carbonyl)amino]pentanoic acid
InChI:
InChI=1S/C15H15NO6/c17-10-5-4-9-7-11(15(21)22-12(9)8-10)14(20)16-6-2-1-3-13(18)19/h4-5,7-8,17H,1-3,6H2,(H,16,20)(H,18,19)
InChI Key:
AYARTTAYIXFPSR-UHFFFAOYSA-N
SMILES:
OC(=O)CCCCNC(=O)c1cc2ccc(cc2oc1=O)O
Properties
Complexity:
486  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
305.09g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
305.286g/mol
Monoisotopic Mass:
305.09g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
113A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties