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110317-48-1 | 3-INDOLYLGLYCINE METHYL ESTER
CAS No: 110317-48-1 Catalog No: AG0083ZJ MDL No:
Product Description
Catalog Number:
AG0083ZJ
Chemical Name:
3-INDOLYLGLYCINE METHYL ESTER
CAS Number:
110317-48-1
Molecular Formula:
C11H12N2O2
Molecular Weight:
204.2252
IUPAC Name:
methyl 2-amino-2-(1H-indol-3-yl)acetate
InChI:
InChI=1S/C11H12N2O2/c1-15-11(14)10(12)8-6-13-9-5-3-2-4-7(8)9/h2-6,10,13H,12H2,1H3
InChI Key:
BFIGWERHCJBNBJ-UHFFFAOYSA-N
SMILES:
COC(=O)CNc1c[nH]c2c1cccc2
Properties
Complexity:
245
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.09g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
204.229g/mol
Monoisotopic Mass:
204.09g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
68.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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