Home Carboxys 5-methyl-1,2,3,4-tetrahydroquinoline-8-carboxylic acid

5-methyl-1,2,3,4-tetrahydroquinoline-8-carboxylic acid

CAS No.:
1823883-36-8
Catalog Number:
AG01BXR5
Molecular Formula:
C11H13NO2
Molecular Weight:
191.2264
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Product Description
Catalog Number:
AG01BXR5
Chemical Name:
5-methyl-1,2,3,4-tetrahydroquinoline-8-carboxylic acid
CAS Number:
1823883-36-8
Molecular Formula:
C11H13NO2
Molecular Weight:
191.2264
MDL Number:
MFCD27923356
IUPAC Name:
5-methyl-1,2,3,4-tetrahydroquinoline-8-carboxylic acid
InChI:
InChI=1S/C11H13NO2/c1-7-4-5-9(11(13)14)10-8(7)3-2-6-12-10/h4-5,12H,2-3,6H2,1H3,(H,13,14)
InChI Key:
FGGWGBMZIWMATJ-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc(c2c1NCCC2)C
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:
2  
Isotope Atom Count:
0
Molecular Weight:
191.23g/mol
Monoisotopic Mass:
191.095g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
49.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties