Home Carboxys 1-Naphthalenecarboxylicacid,4-amino-5,6,7,8-tetrahydro-(9CI)

1-Naphthalenecarboxylicacid,4-amino-5,6,7,8-tetrahydro-(9CI)

CAS No.:
184163-26-6
Catalog Number:
AG00BAS7
Molecular Formula:
C11H13NO2
Molecular Weight:
191.2264
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Product Description
Catalog Number:
AG00BAS7
Chemical Name:
1-Naphthalenecarboxylicacid,4-amino-5,6,7,8-tetrahydro-(9CI)
CAS Number:
184163-26-6
Molecular Formula:
C11H13NO2
Molecular Weight:
191.2264
MDL Number:
MFCD18810660
IUPAC Name:
4-amino-5,6,7,8-tetrahydronaphthalene-1-carboxylic acid
InChI:
InChI=1S/C11H13NO2/c12-10-6-5-9(11(13)14)7-3-1-2-4-8(7)10/h5-6H,1-4,12H2,(H,13,14)
InChI Key:
XULBTYRZTZYIRG-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc(c2c1CCCC2)N
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:
63.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties