Home Carboxys 1-methyl-2,3-dihydro-1H-indole-6-carboxylic acid

1-methyl-2,3-dihydro-1H-indole-6-carboxylic acid

CAS No.:
1071432-99-9
Catalog Number:
AG01A690
Molecular Formula:
C10H11NO2
Molecular Weight:
177.1998
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Product Description
Catalog Number:
AG01A690
Chemical Name:
1-methyl-2,3-dihydro-1H-indole-6-carboxylic acid
CAS Number:
1071432-99-9
Molecular Formula:
C10H11NO2
Molecular Weight:
177.1998
MDL Number:
MFCD20660457
IUPAC Name:
1-methyl-2,3-dihydroindole-6-carboxylic acid
InChI:
InChI=1S/C10H11NO2/c1-11-5-4-7-2-3-8(10(12)13)6-9(7)11/h2-3,6H,4-5H2,1H3,(H,12,13)
InChI Key:
LFRPPHGMTHMKPU-UHFFFAOYSA-N
SMILES:
CN1CCc2c1cc(cc2)C(=O)O
Properties
Complexity:
217  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.079g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
177.203g/mol
Monoisotopic Mass:
177.079g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties