1H-Indole-2-carboxylic acid, 2,3-dihydro-, (2S)-


Chemical Name: 1H-Indole-2-carboxylic acid, 2,3-dihydro-, (2S)-
CAS Number: 79815-20-6
Product Number: AG003CNG(AGN-PC-0OIALQ)
Synonyms:
MDL No: MFCD00070578
Molecular Formula: C9H9NO2
Molecular Weight: 163.1733

Identification/Properties


Properties
MP:
177 °C (dec.)(lit.)
BP:
380 °C at 760 mmHg
Storage:
Inert atmosphere;2-8℃;
Form:
Solid
Refractive Index:
-116 ° (C=1, 2mol/L HCl)
Computed Properties
Molecular Weight:
163.176g/mol
XLogP3:
1.6
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Exact Mass:
163.063g/mol
Monoisotopic Mass:
163.063g/mol
Topological Polar Surface Area:
49.3A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
193
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
1
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-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


Request for Quotation


Customer Feedback