Home Other Building Blocks 4-OXOCHROMAN-7-CARBOXYLIC ACID

4-OXOCHROMAN-7-CARBOXYLIC ACID

CAS No.:
90921-09-8
Catalog Number:
AG01DDVP
Molecular Formula:
C10H8O4
Molecular Weight:
192.1681
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Product Description
Catalog Number:
AG01DDVP
Chemical Name:
4-OXOCHROMAN-7-CARBOXYLIC ACID
CAS Number:
90921-09-8
Molecular Formula:
C10H8O4
Molecular Weight:
192.1681
MDL Number:
MFCD18648339
IUPAC Name:
4-oxo-2,3-dihydrochromene-7-carboxylic acid
InChI:
InChI=1S/C10H8O4/c11-8-3-4-14-9-5-6(10(12)13)1-2-7(8)9/h1-2,5H,3-4H2,(H,12,13)
InChI Key:
UMDDDSGHXQOLKM-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc2c(c1)OCCC2=O
Properties
Complexity:
261  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.042g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
192.17g/mol
Monoisotopic Mass:
192.042g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
63.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Properties