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1273664-66-6

1273664-66-6 | 1H-Indene-4-carboxylic acid, 1-amino-2,3-dihydro-, methyl ester

CAS No: 1273664-66-6 Catalog No: AG000WZS MDL No:

Product Description

Catalog Number:
AG000WZS
Chemical Name:
1H-Indene-4-carboxylic acid, 1-amino-2,3-dihydro-, methyl ester
CAS Number:
1273664-66-6
Molecular Formula:
C11H13NO2
Molecular Weight:
191.2264
IUPAC Name:
methyl 1-amino-2,3-dihydro-1H-indene-4-carboxylate
InChI:
InChI=1S/C11H13NO2/c1-14-11(13)9-4-2-3-8-7(9)5-6-10(8)12/h2-4,10H,5-6,12H2,1H3
InChI Key:
KLNIPXIUYFAARZ-UHFFFAOYSA-N
SMILES:
COC(=O)c1cccc2c1CCC2N

Properties

Complexity:
229  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.095g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
191.23g/mol
Monoisotopic Mass:
191.095g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
52.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  

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