Home Aminos 2-[4-(diethylamino)-2-methylbenzoyl]benzoic acid

2-[4-(diethylamino)-2-methylbenzoyl]benzoic acid

CAS No.:
52830-65-6
Catalog Number:
AG00DKHP
Molecular Formula:
C19H21NO3
Molecular Weight:
311.3749
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Product Description
Catalog Number:
AG00DKHP
Chemical Name:
2-[4-(diethylamino)-2-methylbenzoyl]benzoic acid
CAS Number:
52830-65-6
Molecular Formula:
C19H21NO3
Molecular Weight:
311.3749
MDL Number:
MFCD18970336
IUPAC Name:
2-[4-(diethylamino)-2-methylbenzoyl]benzoic acid
InChI:
InChI=1S/C19H21NO3/c1-4-20(5-2)14-10-11-15(13(3)12-14)18(21)16-8-6-7-9-17(16)19(22)23/h6-12H,4-5H2,1-3H3,(H,22,23)
InChI Key:
IZHHSJHVOYVIRH-UHFFFAOYSA-N
SMILES:
CCN(c1ccc(c(c1)C)C(=O)c1ccccc1C(=O)O)CC
EC Number:
258-210-5
Properties
Complexity:
419  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
311.152g/mol
Formal Charge:
0
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
311.381g/mol
Monoisotopic Mass:
311.152g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
57.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4  
Properties