1H-Indole-1,7-dicarboxylic acid, 2,3-dihydro-, 1-(1,1-dimethylethyl)ester


Chemical Name: 1H-Indole-1,7-dicarboxylic acid, 2,3-dihydro-, 1-(1,1-dimethylethyl)ester
CAS Number: 143262-20-8
Product Number: AG003D4D(AGN-PC-0PTQ8L)
Synonyms:
MDL No:
Molecular Formula: C14H17NO4
Molecular Weight: 263.2891

Identification/Properties


Properties
MP:
182°C
BP:
401.2°C at 760 mmHg
Storage:
2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
263.29g/mol
XLogP3:
2.2
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
3
Exact Mass:
263.115758g/mol
Monoisotopic Mass:
263.115758g/mol
Topological Polar Surface Area:
66.8Ų
Heavy Atom Count:
19
Formal Charge:
0
Complexity:
374
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#:
N/A
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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