Home Carboxys 9,10-Dihydro-10-(2,3-dicarboxypropyl)-9-oxa-10-phosphaphenanthrene 10-oxide

9,10-Dihydro-10-(2,3-dicarboxypropyl)-9-oxa-10-phosphaphenanthrene 10-oxide

CAS No.:
63562-33-4
Catalog Number:
AG00ED0O
Molecular Formula:
C17H15O6P
Molecular Weight:
346.2712
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Product Description
Catalog Number:
AG00ED0O
Chemical Name:
9,10-Dihydro-10-(2,3-dicarboxypropyl)-9-oxa-10-phosphaphenanthrene 10-oxide
CAS Number:
63562-33-4
Molecular Formula:
C17H15O6P
Molecular Weight:
346.2712
MDL Number:
MFCD13152156
IUPAC Name:
2-[(6-oxobenzo[c][2,1]benzoxaphosphinin-6-yl)methyl]butanedioic acid
InChI:
InChI=1S/C17H15O6P/c18-16(19)9-11(17(20)21)10-24(22)15-8-4-2-6-13(15)12-5-1-3-7-14(12)23-24/h1-8,11H,9-10H2,(H,18,19)(H,20,21)
InChI Key:
XZAXQWXHBDKYJI-UHFFFAOYSA-N
SMILES:
OC(=O)CC(C(=O)O)CP1(=O)Oc2ccccc2c2c1cccc2
EC Number:
426-480-5
Properties
Complexity:
547  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
346.061g/mol
Formal Charge:
0
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
346.275g/mol
Monoisotopic Mass:
346.061g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
101A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties