Home Aminos 4-[(2-tert-butylphenyl)amino]benzoic acid

4-[(2-tert-butylphenyl)amino]benzoic acid

CAS No.:
1410319-79-7
Catalog Number:
AG01BRK1
Molecular Formula:
C17H19NO2
Molecular Weight:
269.3383
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Product Description
Catalog Number:
AG01BRK1
Chemical Name:
4-[(2-tert-butylphenyl)amino]benzoic acid
CAS Number:
1410319-79-7
Molecular Formula:
C17H19NO2
Molecular Weight:
269.3383
MDL Number:
MFCD30535768
IUPAC Name:
4-(2-tert-butylanilino)benzoic acid
InChI:
InChI=1S/C17H19NO2/c1-17(2,3)14-6-4-5-7-15(14)18-13-10-8-12(9-11-13)16(19)20/h4-11,18H,1-3H3,(H,19,20)
InChI Key:
WHYYJFNISYKBKI-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc(cc1)Nc1ccccc1C(C)(C)C
Properties
Complexity:
326  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
269.142g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
269.344g/mol
Monoisotopic Mass:
269.142g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
49.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7  
Properties