Pentacyclo[4.2.0.02,5.03,8.04,7]octane-1,4-dicarboxylic acid


Chemical Name: Pentacyclo[4.2.0.02,5.03,8.04,7]octane-1,4-dicarboxylic acid
CAS Number: 32846-66-5
Product Number: AG007IPG(AGN-PC-0JP2CK)
Synonyms:
MDL No:
Molecular Formula: C10H8O4
Molecular Weight: 192.1681

Identification/Properties


Computed Properties
Molecular Weight:
192.17g/mol
XLogP3:
-0.7
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
2
Exact Mass:
192.042g/mol
Monoisotopic Mass:
192.042g/mol
Topological Polar Surface Area:
74.6A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
356
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P305+P351+P338-P312-P321-P330-P332+P313-P362-P403+P233-P405-P501
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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