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187884-86-2 | Glycine, N-(3,4-dihydro-3,3-dimethyl-1-isoquinolinyl)-
CAS No: 187884-86-2 Catalog No: AG002GJT MDL No:
Product Description
Catalog Number:
AG002GJT
Chemical Name:
Glycine, N-(3,4-dihydro-3,3-dimethyl-1-isoquinolinyl)-
CAS Number:
187884-86-2
Molecular Formula:
C13H16N2O2
Molecular Weight:
232.2783
IUPAC Name:
2-[(3,3-dimethyl-2,4-dihydroisoquinolin-1-ylidene)amino]acetic acid
InChI:
InChI=1S/C13H16N2O2/c1-13(2)7-9-5-3-4-6-10(9)12(15-13)14-8-11(16)17/h3-6H,7-8H2,1-2H3,(H,14,15)(H,16,17)
InChI Key:
RHVLVOXVZFRCAX-UHFFFAOYSA-N
SMILES:
OC(=O)CNC1=NC(C)(C)Cc2c1cccc2
Properties
Complexity:
336
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
232.121g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
232.283g/mol
Monoisotopic Mass:
232.121g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
61.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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